N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide

C66H89F2N9O9S — CID 159317103

IUPACN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide
SMILESCC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1
InChIInChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C12H18N2O.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);6-9H,4-5H2,1-3H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14)
InChIKeyLDGVTOLZUHBBBD-UHFFFAOYSA-N
MW1222.55 g/mol
LogP11.84
Rot. Bonds20

About N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide

N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide (PubChem CID 159317103) has the molecular formula C66H89F2N9O9S and a molecular weight of 1222.55 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide
PubChem CID159317103
Molecular FormulaC66H89F2N9O9S
Molecular Weight1222.55 g/mol
Exact Mass1221.65
IUPAC NameN-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide
SMILESCC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1
InChIInChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C12H18N2O.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);6-9H,4-5H2,1-3H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14)
InChIKeyLDGVTOLZUHBBBD-UHFFFAOYSA-N
XLogP11.84
TPSA242.68 Ų
H-Bond Donors4
H-Bond Acceptors14
Rotatable Bonds20
Heavy Atoms87
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001222.55
LogP ≤ 511.84
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1014

Analyze N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide with MolForge

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Related Compounds

5-bromo-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 62329650
3-fluoro-N-(oxolan-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 105386978
5-N-cyclohexyl-3-N-propylpyridine-3,5-dicarboxamide
CID 109101138
6-(3-methoxyanilino)-N-(oxan-4-ylmethyl)-4-propan-2-ylpyridine-3-carboxamide
CID 44569924
3-fluoro-4-methoxy-N-(oxolan-3-yl)benzamide
CID 86780875
2-fluoro-4-methoxy-N-(oxolan-3-ylmethyl)benzamide
CID 113222377
5-fluoro-N-[[(2R,3R)-2-propan-2-yloxolan-3-yl]methyl]pyridine-3-carboxamide
CID 129000479
3-fluoro-2-methoxy-5-(oxolan-3-ylcarbamoyl)benzenesulfonyl chloride
CID 80716247
2-chloro-4-fluoro-N-(oxolan-3-ylmethyl)-5-sulfamoylbenzamide
CID 65387506
5-[(2,5-dimethoxyphenyl)sulfonylmethyl]-N-[2-(dimethylamino)ethyl]pyridine-3-carboxamide
CID 158000615
N-[(2,4-difluorophenyl)methyl]-5-fluoro-2-methoxypyridine-3-carboxamide
CID 171547542
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide (CID 159317103) is N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide is CC(C)c1cncc(CS(=O)(=O)c2ccc(F)cc2F)c1.CCCNC(=O)c1cncc(C(C)C)c1.CCNC(=O)c1cncc(C(C)C)c1.COc1ncc(C(C)C)cc1C(=O)NC1CCOC1.COc1ncc(C(C)C)cc1C(=O)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide?
The InChIKey is LDGVTOLZUHBBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F2NO2S.C14H20N2O3.C14H20N2O2.C12H18N2O.C11H16N2O/c1-10(2)12-5-11(7-18-8-12)9-21(19,20)15-4-3-13(16)6-14(15)17;1-9(2)10-6-12(14(18-3)15-7-10)13(17)16-11-4-5-19-8-11;1-9(2)11-6-12(14(18-3)16-8-11)13(17)15-7-10-4-5-10;1-4-5-14-12(15)11-6-10(9(2)3)7-13-8-11;1-4-13-11(14)10-5-9(8(2)3)6-12-7-10/h3-8,10H,9H2,1-2H3;6-7,9,11H,4-5,8H2,1-3H3,(H,16,17);6,8-10H,4-5,7H2,1-3H3,(H,15,17);6-9H,4-5H2,1-3H3,(H,14,15);5-8H,4H2,1-3H3,(H,13,14).
What are the key properties of N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide?
N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide has a molecular weight of 1222.55 g/mol, XLogP of 11.84, 20 rotatable bonds, 4 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-methoxy-5-propan-2-ylpyridine-3-carboxamide;3-[(2,4-difluorophenyl)sulfonylmethyl]-5-propan-2-ylpyridine;N-ethyl-5-propan-2-ylpyridine-3-carboxamide;2-methoxy-N-(oxolan-3-yl)-5-propan-2-ylpyridine-3-carboxamide;5-propan-2-yl-N-propylpyridine-3-carboxamide is sourced from PubChem (CID 159317103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).