N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide

C20H16ClN3O2 — CID 108925493

IUPACN-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(NC(=O)c2ccccc2Cl)cc1)c1cccnc1
InChIInChI=1S/C20H16ClN3O2/c21-18-6-2-1-5-17(18)20(26)24-16-9-7-14(8-10-16)12-23-19(25)15-4-3-11-22-13-15/h1-11,13H,12H2,(H,23,25)(H,24,26)
InChIKeyUHYXYALINSXMIO-UHFFFAOYSA-N
MW365.82 g/mol
LogP3.92
Rot. Bonds5

About N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide

N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide (PubChem CID 108925493) has the molecular formula C20H16ClN3O2 and a molecular weight of 365.82 g/mol. Its IUPAC name is N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
PubChem CID108925493
Molecular FormulaC20H16ClN3O2
Molecular Weight365.82 g/mol
Exact Mass365.09
IUPAC NameN-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(NC(=O)c2ccccc2Cl)cc1)c1cccnc1
InChIInChI=1S/C20H16ClN3O2/c21-18-6-2-1-5-17(18)20(26)24-16-9-7-14(8-10-16)12-23-19(25)15-4-3-11-22-13-15/h1-11,13H,12H2,(H,23,25)(H,24,26)
InChIKeyUHYXYALINSXMIO-UHFFFAOYSA-N
XLogP3.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.82
LogP ≤ 53.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[(4-chlorobenzoyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925476
N-[[4-[(2-chloro-6-fluorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925692
N-[4-[[(2-phenylacetyl)amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925504
N-benzylpyridine-3-carboxamide chloride
CID 21204170
2-chloro-N-(pyridin-3-ylmethyl)benzamide
CID 669068
N-[4-[[[2-(2-chloro-4-hydroxyphenyl)acetyl]amino]methyl]phenyl]pyridine-3-carboxamide
CID 167869744
N-[4-[[[2-(2-fluorophenyl)acetyl]amino]methyl]phenyl]pyridine-3-carboxamide
CID 108925705
N-[[4-(pentanoylamino)phenyl]methyl]pyridine-3-carboxamide
CID 108925618
N-[[4-[(4-ethoxybenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide
CID 108925525
N-[[4-[3-(3-chlorophenyl)propanoylamino]phenyl]methyl]pyridine-3-carboxamide
CID 108925742
N-[(4-carbamoylphenyl)methyl]pyridine-3-carboxamide
CID 108766189
N-[4-[(4-oxopentanoylamino)methyl]phenyl]pyridine-3-carboxamide
CID 108925682

Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide?
The IUPAC name of N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide (CID 108925493) is N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide?
The canonical SMILES for N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide is O=C(NCc1ccc(NC(=O)c2ccccc2Cl)cc1)c1cccnc1.
What is the InChIKey of N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide?
The InChIKey is UHYXYALINSXMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClN3O2/c21-18-6-2-1-5-17(18)20(26)24-16-9-7-14(8-10-16)12-23-19(25)15-4-3-11-22-13-15/h1-11,13H,12H2,(H,23,25)(H,24,26).
What are the key properties of N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide?
N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide has a molecular weight of 365.82 g/mol, XLogP of 3.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2-chlorobenzoyl)amino]phenyl]methyl]pyridine-3-carboxamide is sourced from PubChem (CID 108925493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).