3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine

C131H167N25O21 — CID 160834379

IUPAC3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine
SMILES[H]/N=C(\N)c1ccc(/C=C/C(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(/C=C/C(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(C)=O)c1.c1cc(N2CCCCC2)ccn1
InChIInChI=1S/C27H35N5O4.C27H33N5O4.C26H33N5O5.C26H31N5O5.C15H21N3O3.C10H14N2/c2*1-18(33)3-4-20-5-6-22(26(29)30)17-25(20)35-16-13-31-27(34)21-7-9-23(10-8-21)36-24-11-14-32(15-12-24)19(2)28;2*1-17(27)31-13-10-22(11-14-31)36-21-7-4-19(5-8-21)26(34)30-12-15-35-23-16-20(25(28)29)3-2-18(23)6-9-24(32)33;1-10(19)3-4-12-5-6-13(15(16)17)9-14(12)21-8-7-18-11(2)20;1-2-8-12(9-3-1)10-4-6-11-7-5-10/h5-10,17,24,28H,3-4,11-16H2,1-2H3,(H3,29,30)(H,31,34);3-10,17,24,28H,11-16H2,1-2H3,(H3,29,30)(H,31,34);2-5,7-8,16,22,27H,6,9-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);2-9,16,22,27H,10-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);5-6,9H,3-4,7-8H2,1-2H3,(H3,16,17)(H,18,20);4-7H,1-3,8-9H2/b28-19+;4-3+,28-19+;27-17+;9-6+,27-17+;;
InChIKeySHFIXAUMDBGNFK-AKDXLVDXSA-N
MW2427.93 g/mol
LogP14.80
Rot. Bonds51

About 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine

3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine (PubChem CID 160834379) has the molecular formula C131H167N25O21 and a molecular weight of 2427.93 g/mol. Its IUPAC name is 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine.

Molecular Properties

Compound Name3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine
PubChem CID160834379
Molecular FormulaC131H167N25O21
Molecular Weight2427.93 g/mol
Exact Mass2426.28
IUPAC Name3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine
SMILES[H]/N=C(\N)c1ccc(/C=C/C(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(/C=C/C(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(C)=O)c1.c1cc(N2CCCCC2)ccn1
InChIInChI=1S/C27H35N5O4.C27H33N5O4.C26H33N5O5.C26H31N5O5.C15H21N3O3.C10H14N2/c2*1-18(33)3-4-20-5-6-22(26(29)30)17-25(20)35-16-13-31-27(34)21-7-9-23(10-8-21)36-24-11-14-32(15-12-24)19(2)28;2*1-17(27)31-13-10-22(11-14-31)36-21-7-4-19(5-8-21)26(34)30-12-15-35-23-16-20(25(28)29)3-2-18(23)6-9-24(32)33;1-10(19)3-4-12-5-6-13(15(16)17)9-14(12)21-8-7-18-11(2)20;1-2-8-12(9-3-1)10-4-6-11-7-5-10/h5-10,17,24,28H,3-4,11-16H2,1-2H3,(H3,29,30)(H,31,34);3-10,17,24,28H,11-16H2,1-2H3,(H3,29,30)(H,31,34);2-5,7-8,16,22,27H,6,9-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);2-9,16,22,27H,10-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);5-6,9H,3-4,7-8H2,1-2H3,(H3,16,17)(H,18,20);4-7H,1-3,8-9H2/b28-19+;4-3+,28-19+;27-17+;9-6+,27-17+;;
InChIKeySHFIXAUMDBGNFK-AKDXLVDXSA-N
XLogP14.80
TPSA728.22 Ų
H-Bond Donors21
H-Bond Acceptors30
Rotatable Bonds51
Heavy Atoms177
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002427.93
LogP ≤ 514.80
H-Bond Donors ≤ 521
H-Bond Acceptors ≤ 1030

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine with MolForge

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Related Compounds

3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-1-pyridin-4-ylpiperidine-4-carboxamide;3-[4-carbamimidoyl-2-[2-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]ethoxy]phenyl]propanoic acid
CID 159266479
N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide
CID 22083118
3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;3-[4-carbamimidoyl-2-[2-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]ethoxy]phenyl]propanoic acid;ethyl 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoate;ethyl (E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoate;ethyl 3-[4-carbamimidoyl-2-[2-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]ethoxy]phenyl]propanoate;methane;2,2,4,4-tetrafluoro-3-hydroperoxybut-3-enoic acid
CID 162037756
3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]-2-oxopropanoic acid;bis(2,2,2-trifluoroacetic acid)
CID 87591095
methyl 4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]benzoate
CID 15486827
2-[4-carbamimidoyl-2-[2-[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]oxyethoxy]phenoxy]acetic acid
CID 11648982
3-[N-(7-carbamimidoylnaphthalene-2-carbonyl)-4-(1-ethanimidoylpiperidin-4-yl)oxyanilino]propanoic acid;dihydrochloride
CID 139881447
2-[(7-carbamimidoylnaphthalene-2-carbonyl)-[4-(1-ethanimidoylpiperidin-4-yl)oxyphenyl]sulfamoyl]acetic acid
CID 67597449
2-(3-carbamimidoylphenoxy)ethyl 4-(1-ethanimidoylpiperidin-4-yl)oxybenzoate;1,1,1,4,4,4-hexafluorobutane-2,3-dione
CID 159663730
methyl 3-(3-carbamimidoylphenyl)-2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]propanoate
CID 10276641
2-[N-(7-carbamimidoylnaphthalene-2-carbonyl)-4-(1-ethanimidoylpiperidin-4-yl)oxyanilino]acetic acid
CID 139881441
(E)-3-[1-amino-7-[2-[(1-pyridin-4-ylpiperidine-4-carbonyl)amino]ethoxy]isoquinolin-6-yl]prop-2-enoic acid
CID 22631379

Frequently Asked Questions

What is the IUPAC name of 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine?
The IUPAC name of 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine (CID 160834379) is 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine.
What is the SMILES notation for 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine?
The canonical SMILES for 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine is [H]/N=C(\N)c1ccc(/C=C/C(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(/C=C/C(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(=O)O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(=O)c2ccc(OC3CCN(/C(C)=N/[H])CC3)cc2)c1.[H]/N=C(\N)c1ccc(CCC(C)=O)c(OCCNC(C)=O)c1.c1cc(N2CCCCC2)ccn1.
What is the InChIKey of 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine?
The InChIKey is SHFIXAUMDBGNFK-AKDXLVDXSA-N. The full InChI is InChI=1S/C27H35N5O4.C27H33N5O4.C26H33N5O5.C26H31N5O5.C15H21N3O3.C10H14N2/c2*1-18(33)3-4-20-5-6-22(26(29)30)17-25(20)35-16-13-31-27(34)21-7-9-23(10-8-21)36-24-11-14-32(15-12-24)19(2)28;2*1-17(27)31-13-10-22(11-14-31)36-21-7-4-19(5-8-21)26(34)30-12-15-35-23-16-20(25(28)29)3-2-18(23)6-9-24(32)33;1-10(19)3-4-12-5-6-13(15(16)17)9-14(12)21-8-7-18-11(2)20;1-2-8-12(9-3-1)10-4-6-11-7-5-10/h5-10,17,24,28H,3-4,11-16H2,1-2H3,(H3,29,30)(H,31,34);3-10,17,24,28H,11-16H2,1-2H3,(H3,29,30)(H,31,34);2-5,7-8,16,22,27H,6,9-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);2-9,16,22,27H,10-15H2,1H3,(H3,28,29)(H,30,34)(H,32,33);5-6,9H,3-4,7-8H2,1-2H3,(H3,16,17)(H,18,20);4-7H,1-3,8-9H2/b28-19+;4-3+,28-19+;27-17+;9-6+,27-17+;;.
What are the key properties of 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine?
3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine has a molecular weight of 2427.93 g/mol, XLogP of 14.80, 51 rotatable bonds, 21 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]propanoic acid;(E)-3-[4-carbamimidoyl-2-[2-[[4-(1-ethanimidoylpiperidin-4-yl)oxybenzoyl]amino]ethoxy]phenyl]prop-2-enoic acid;N-[2-[5-carbamimidoyl-2-[(E)-3-oxobut-1-enyl]phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]acetamide;N-[2-[5-carbamimidoyl-2-(3-oxobutyl)phenoxy]ethyl]-4-(1-ethanimidoylpiperidin-4-yl)oxybenzamide;4-piperidin-1-ylpyridine is sourced from PubChem (CID 160834379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).