N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide

C50H46Cl2N8O4 — CID 157291180

IUPACN-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide
SMILESCCN1CCN=C1c1ccc(C(=O)Cc2ccccc2CC(=O)Nc2ccc(Cl)cn2)cc1.O=C(Cc1ccccc1CC(=O)c1ccc(C2=NCCN2)cc1)Nc1ccc(Cl)cn1
InChIInChI=1S/C26H25ClN4O2.C24H21ClN4O2/c1-2-31-14-13-28-26(31)19-9-7-18(8-10-19)23(32)15-20-5-3-4-6-21(20)16-25(33)30-24-12-11-22(27)17-29-24;25-20-9-10-22(28-15-20)29-23(31)14-19-4-2-1-3-18(19)13-21(30)16-5-7-17(8-6-16)24-26-11-12-27-24/h3-12,17H,2,13-16H2,1H3,(H,29,30,33);1-10,15H,11-14H2,(H,26,27)(H,28,29,31)
InChIKeyBAUYZJYAPKVYGT-UHFFFAOYSA-N
MW893.88 g/mol
LogP8.12
Rot. Bonds15

About N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide

N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide (PubChem CID 157291180) has the molecular formula C50H46Cl2N8O4 and a molecular weight of 893.88 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide
PubChem CID157291180
Molecular FormulaC50H46Cl2N8O4
Molecular Weight893.88 g/mol
Exact Mass892.30
IUPAC NameN-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide
SMILESCCN1CCN=C1c1ccc(C(=O)Cc2ccccc2CC(=O)Nc2ccc(Cl)cn2)cc1.O=C(Cc1ccccc1CC(=O)c1ccc(C2=NCCN2)cc1)Nc1ccc(Cl)cn1
InChIInChI=1S/C26H25ClN4O2.C24H21ClN4O2/c1-2-31-14-13-28-26(31)19-9-7-18(8-10-19)23(32)15-20-5-3-4-6-21(20)16-25(33)30-24-12-11-22(27)17-29-24;25-20-9-10-22(28-15-20)29-23(31)14-19-4-2-1-3-18(19)13-21(30)16-5-7-17(8-6-16)24-26-11-12-27-24/h3-12,17H,2,13-16H2,1H3,(H,29,30,33);1-10,15H,11-14H2,(H,26,27)(H,28,29,31)
InChIKeyBAUYZJYAPKVYGT-UHFFFAOYSA-N
XLogP8.12
TPSA158.11 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds15
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500893.88
LogP ≤ 58.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide with MolForge

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Related Compounds

5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-[2-(N,N-dimethylcarbamimidoyl)phenyl]benzoyl]amino]benzamide
CID 10075735
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CID 10347471
2-[[4-[2-[(1-aminoethylideneamino)methyl]phenyl]benzoyl]amino]-5-chloro-N-(5-chloro-2-pyridinyl)benzamide
CID 44385552
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-[2-(4-methylpiperazin-1-yl)phenyl]benzoyl]amino]benzamide
CID 44385561
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-(2-piperazin-1-ylphenyl)benzoyl]amino]benzamide
CID 44385953
N-[(2S)-4-[(5-chloro-2-pyridinyl)amino]-1,4-dioxo-1-piperidin-1-ylbutan-2-yl]-4-[2-[(dimethylamino)methyl]phenyl]benzamide
CID 44393407
5-chloro-N-(5-chloro-2-pyridinyl)-2-[[4-[2-[(dimethylamino)methyl]phenyl]benzoyl]amino]benzamide
CID 52941698
{4-[2-(Aminomethyl)phenyl]phenyl}-n-{2-[n-(5-chloro(2-pyridyl))carbamoyl]-phenyl}carboxamide
CID 18727717
N-(5-chloropyridin-2-yl)-2-(4-(imino(4-methylpiperazin-1-yl)methyl)benzamido)benzamide
CID 18727967
N-(5-chloropyridin-2-yl)-2-(4-(imino(piperazin-1-yl)methyl)benzamido)benzamide
CID 18728129
N-[4-chloro-3-[3-(cyclopropanecarbonylamino)isoquinolin-7-yl]phenyl]-4-[(4-methylpiperazin-1-yl)methyl]benzamide
CID 71115272
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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide (CID 157291180) is N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide is CCN1CCN=C1c1ccc(C(=O)Cc2ccccc2CC(=O)Nc2ccc(Cl)cn2)cc1.O=C(Cc1ccccc1CC(=O)c1ccc(C2=NCCN2)cc1)Nc1ccc(Cl)cn1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide?
The InChIKey is BAUYZJYAPKVYGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25ClN4O2.C24H21ClN4O2/c1-2-31-14-13-28-26(31)19-9-7-18(8-10-19)23(32)15-20-5-3-4-6-21(20)16-25(33)30-24-12-11-22(27)17-29-24;25-20-9-10-22(28-15-20)29-23(31)14-19-4-2-1-3-18(19)13-21(30)16-5-7-17(8-6-16)24-26-11-12-27-24/h3-12,17H,2,13-16H2,1H3,(H,29,30,33);1-10,15H,11-14H2,(H,26,27)(H,28,29,31).
What are the key properties of N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide?
N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide has a molecular weight of 893.88 g/mol, XLogP of 8.12, 15 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide;N-(5-chloro-2-pyridinyl)-2-[2-[2-[4-(1-ethyl-4,5-dihydroimidazol-2-yl)phenyl]-2-oxoethyl]phenyl]acetamide is sourced from PubChem (CID 157291180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).