N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide

C9H11N3O2 — CID 58188881

IUPACN-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
SMILESCNC(=O)CNC(=O)c1ccncc1
InChIInChI=1S/C9H11N3O2/c1-10-8(13)6-12-9(14)7-2-4-11-5-3-7/h2-5H,6H2,1H3,(H,10,13)(H,12,14)
InChIKeyDSMQVBWCWSCKCG-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.44
Rot. Bonds3

About N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide

N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide (PubChem CID 58188881) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
PubChem CID58188881
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC NameN-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
SMILESCNC(=O)CNC(=O)c1ccncc1
InChIInChI=1S/C9H11N3O2/c1-10-8(13)6-12-9(14)7-2-4-11-5-3-7/h2-5H,6H2,1H3,(H,10,13)(H,12,14)
InChIKeyDSMQVBWCWSCKCG-UHFFFAOYSA-N
XLogP-0.44
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(methylamino)-2-oxoethyl]carbamoyl]benzoic acid
CID 43414345
2-fluoro-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 61293980
N-(3,3-dimethyl-2-oxobutyl)pyridine-4-carboxamide
CID 856904
N-[2-(2,4-dimethylpentan-2-ylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 129231902
4-methoxy-N-[2-oxo-2-[2-(pyridine-4-carbonyl)hydrazinyl]ethyl]benzamide
CID 4628077
N-[2-(cyclohexylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 47172514
2,6-dichloro-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 38004196
N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65109884
N-butylpyridine-4-carboxamide
CID 5030535
N-[2-oxo-2-[2-(1-phenylpropan-2-ylidene)hydrazinyl]ethyl]pyridine-4-carboxamide
CID 3412755
N-pentylpyridine-4-carboxamide
CID 2307296
N-(3,3-dimethylbutyl)pyridine-4-carboxamide
CID 68891384

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide?
The IUPAC name of N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide (CID 58188881) is N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide?
The canonical SMILES for N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide is CNC(=O)CNC(=O)c1ccncc1.
What is the InChIKey of N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide?
The InChIKey is DSMQVBWCWSCKCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-10-8(13)6-12-9(14)7-2-4-11-5-3-7/h2-5H,6H2,1H3,(H,10,13)(H,12,14).
What are the key properties of N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide?
N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide has a molecular weight of 193.21 g/mol, XLogP of -0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide is sourced from PubChem (CID 58188881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).