N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide

C15H14ClN3O2 — CID 103745282

IUPACN-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1cc(NC(=O)CNC(=O)c2ccccc2)cnc1Cl
InChIInChI=1S/C15H14ClN3O2/c1-10-7-12(8-17-14(10)16)19-13(20)9-18-15(21)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,21)(H,19,20)
InChIKeyUGQRPRXYCUJGAR-UHFFFAOYSA-N
MW303.75 g/mol
LogP2.41
Rot. Bonds4

About N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide

N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide (PubChem CID 103745282) has the molecular formula C15H14ClN3O2 and a molecular weight of 303.75 g/mol. Its IUPAC name is N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide
PubChem CID103745282
Molecular FormulaC15H14ClN3O2
Molecular Weight303.75 g/mol
Exact Mass303.08
IUPAC NameN-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide
SMILESCc1cc(NC(=O)CNC(=O)c2ccccc2)cnc1Cl
InChIInChI=1S/C15H14ClN3O2/c1-10-7-12(8-17-14(10)16)19-13(20)9-18-15(21)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,21)(H,19,20)
InChIKeyUGQRPRXYCUJGAR-UHFFFAOYSA-N
XLogP2.41
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.75
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 103730447
N-[2-(3-methylanilino)-2-oxoethyl]benzamide
CID 2968363
5-[(6-chloro-5-methyl-3-pyridinyl)amino]-3,3-dimethyl-5-oxopentanoic acid
CID 114049207
N-[2-[(1-tert-butylpyrazol-4-yl)amino]-2-oxoethyl]benzamide
CID 86861977
N-(2-anilino-2-oxoethyl)-4-methylbenzamide
CID 4010991
N-[2-(5-fluoro-2-methylanilino)-2-oxoethyl]benzamide
CID 9211846
N-(6-chloro-5-methyl-3-pyridinyl)pent-4-enamide
CID 103730487
N-[2-(5-benzamido-2-methylanilino)-2-oxoethyl]benzamide
CID 60518009
N-(6-chloro-5-methyl-3-pyridinyl)-4-(methylamino)butanamide
CID 103811529
2-methyl-N-[2-oxo-2-[(2-phenylpyrimidin-5-yl)amino]ethyl]benzamide
CID 134056276
N-[2-[[2-(4-methylpiperidin-1-yl)pyrimidin-5-yl]amino]-2-oxoethyl]benzamide
CID 122299598
4-bromo-N-(6-chloro-5-methyl-3-pyridinyl)-3-methylbenzamide
CID 114049068

Frequently Asked Questions

What is the IUPAC name of N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide (CID 103745282) is N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide is Cc1cc(NC(=O)CNC(=O)c2ccccc2)cnc1Cl.
What is the InChIKey of N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide?
The InChIKey is UGQRPRXYCUJGAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3O2/c1-10-7-12(8-17-14(10)16)19-13(20)9-18-15(21)11-5-3-2-4-6-11/h2-8H,9H2,1H3,(H,18,21)(H,19,20).
What are the key properties of N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide?
N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide has a molecular weight of 303.75 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(6-chloro-5-methyl-3-pyridinyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 103745282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).