N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide

C14H13ClN4O2 — CID 39184826

IUPACN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide
SMILESNCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccnc2)c1
InChIInChI=1S/C14H13ClN4O2/c15-11-4-3-10(18-13(20)7-16)6-12(11)19-14(21)9-2-1-5-17-8-9/h1-6,8H,7,16H2,(H,18,20)(H,19,21)
InChIKeyMCRCKPKWDVWADB-UHFFFAOYSA-N
MW304.74 g/mol
LogP1.88
Rot. Bonds4

About N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide

N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide (PubChem CID 39184826) has the molecular formula C14H13ClN4O2 and a molecular weight of 304.74 g/mol. Its IUPAC name is N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide
PubChem CID39184826
Molecular FormulaC14H13ClN4O2
Molecular Weight304.74 g/mol
Exact Mass304.07
IUPAC NameN-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide
SMILESNCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccnc2)c1
InChIInChI=1S/C14H13ClN4O2/c15-11-4-3-10(18-13(20)7-16)6-12(11)19-14(21)9-2-1-5-17-8-9/h1-6,8H,7,16H2,(H,18,20)(H,19,21)
InChIKeyMCRCKPKWDVWADB-UHFFFAOYSA-N
XLogP1.88
TPSA97.11 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.74
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-chlorobenzamide
CID 39184820
N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-methoxybenzamide
CID 39184782
N-[2-[(2-aminoacetyl)amino]-4-fluorophenyl]pyridine-3-carboxamide
CID 39184022
N-(4-chloro-3-fluorophenyl)pyridine-3-carboxamide
CID 47227911
N-[3-[[2-(2-chlorophenyl)acetyl]amino]phenyl]pyridine-3-carboxamide
CID 108925213
N-[5-(3-aminopropanoylamino)-2-chlorophenyl]-4-methylbenzamide
CID 82034457
N-(2-chloro-4-hydroxyphenyl)pyridine-3-carboxamide
CID 64787918
N-(3-benzamido-4-methylphenyl)pyridine-3-carboxamide
CID 6486649
N-[2-chloro-5-[(6-chloro-4-methylsulfonylcyclohexa-1,5-diene-1-carbonyl)amino]phenyl]pyridine-3-carboxamide
CID 143465762
N-[4-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-fluorobenzamide
CID 39186063
N-[4-[(2-aminoacetyl)amino]-2-chlorophenyl]-3-methylbenzamide
CID 39186055
N-[3-(4-aminobutanoylamino)-4-chlorophenyl]pyridine-4-carboxamide
CID 39193137

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide?
The IUPAC name of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide (CID 39184826) is N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide?
The canonical SMILES for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide is NCC(=O)Nc1ccc(Cl)c(NC(=O)c2cccnc2)c1.
What is the InChIKey of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide?
The InChIKey is MCRCKPKWDVWADB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN4O2/c15-11-4-3-10(18-13(20)7-16)6-12(11)19-14(21)9-2-1-5-17-8-9/h1-6,8H,7,16H2,(H,18,20)(H,19,21).
What are the key properties of N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide?
N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide has a molecular weight of 304.74 g/mol, XLogP of 1.88, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2-aminoacetyl)amino]-2-chlorophenyl]pyridine-3-carboxamide is sourced from PubChem (CID 39184826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).