N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide

C9H11N3O2 — CID 78953566

IUPACN-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NCC(N)=O
InChIInChI=1S/C9H11N3O2/c1-6-7(3-2-4-11-6)9(14)12-5-8(10)13/h2-4H,5H2,1H3,(H2,10,13)(H,12,14)
InChIKeyAKTMBTSMOLMILT-UHFFFAOYSA-N
MW193.21 g/mol
LogP-0.39
Rot. Bonds3

About N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide

N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide (PubChem CID 78953566) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide
PubChem CID78953566
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC NameN-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide
SMILESCc1ncccc1C(=O)NCC(N)=O
InChIInChI=1S/C9H11N3O2/c1-6-7(3-2-4-11-6)9(14)12-5-8(10)13/h2-4H,5H2,1H3,(H2,10,13)(H,12,14)
InChIKeyAKTMBTSMOLMILT-UHFFFAOYSA-N
XLogP-0.39
TPSA85.08 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 ≤ 5-0.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-amino-2-oxoethyl)-2-(methylamino)pyridine-3-carboxamide
CID 62172228
N-methoxy-2-methylpyridine-3-carboxamide
CID 78950808
N-[(4-hydroxythian-4-yl)methyl]-2-methylpyridine-3-carboxamide
CID 111484670
methyl 3-[(2-methylpyridine-3-carbonyl)amino]propanoate
CID 78950792
N-hexyl-2-methylpyridine-3-carboxamide
CID 67377746
N-[(4-bromophenyl)methyl]-2-methylpyridine-3-carboxamide
CID 78950948
2-ethyl-2-[[(2-methylpyridine-3-carbonyl)amino]methyl]butanoic acid
CID 115429550
N-(3,3-diphenylpropyl)-2-methylpyridine-3-carboxamide
CID 11976200
N-(4-bromo-2-methylbutyl)-2-methylpyridine-3-carboxamide
CID 114316893
N-[2-(2-hydroxypropylamino)ethyl]-2-methylpyridine-3-carboxamide
CID 104593577
N-[(4-cyanophenyl)methyl]-2-methylpyridine-3-carboxamide
CID 78951088
N-(2-bromo-2-cyclopropylethyl)-2-methylpyridine-3-carboxamide
CID 114315880

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide (CID 78953566) is N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide is Cc1ncccc1C(=O)NCC(N)=O.
What is the InChIKey of N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide?
The InChIKey is AKTMBTSMOLMILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-6-7(3-2-4-11-6)9(14)12-5-8(10)13/h2-4H,5H2,1H3,(H2,10,13)(H,12,14).
What are the key properties of N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide?
N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide has a molecular weight of 193.21 g/mol, XLogP of -0.39, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 78953566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).