N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide

C14H20N2O2 — CID 113224073

IUPACN-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide
SMILESCC(C)N(CC1CC1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C14H20N2O2/c1-10(2)16(9-11-4-5-11)14(18)12-6-7-15(3)13(17)8-12/h6-8,10-11H,4-5,9H2,1-3H3
InChIKeyCCOKHAPGESZVAK-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.65
Rot. Bonds4

About N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide

N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide (PubChem CID 113224073) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide
PubChem CID113224073
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide
SMILESCC(C)N(CC1CC1)C(=O)c1ccn(C)c(=O)c1
InChIInChI=1S/C14H20N2O2/c1-10(2)16(9-11-4-5-11)14(18)12-6-7-15(3)13(17)8-12/h6-8,10-11H,4-5,9H2,1-3H3
InChIKeyCCOKHAPGESZVAK-UHFFFAOYSA-N
XLogP1.65
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyanomethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide
CID 103758621
methyl 2-[(1-methyl-2-oxopyridine-4-carbonyl)-propan-2-ylamino]acetate
CID 54941998
3,5-dibromo-N-(cyclopropylmethyl)-N-propan-2-ylbenzamide
CID 103907777
3-[ethyl-(1-methyl-2-oxopyridine-4-carbonyl)amino]butanoic acid
CID 55123665
3-chloro-N-(cyclopropylmethyl)-4-hydroxy-N-propan-2-ylbenzamide
CID 55000544
3-bromo-N-(cyclopropylmethyl)-4-methoxy-N-propan-2-ylbenzamide
CID 54942821
3-carbamothioyl-N-(cyclopropylmethyl)-N-propan-2-ylbenzamide
CID 55000146
N,N,1-trimethyl-2-oxopyridine-4-carboxamide
CID 60735672
4-amino-N-(cyclopropylmethyl)-N-propan-2-yl-3-(trifluoromethyl)benzamide
CID 62185001
N-ethyl-N,1-dimethyl-2-oxopyridine-4-carboxamide
CID 103612566
2-[carboxymethyl-(1-methyl-2-oxopyridine-4-carbonyl)amino]acetic acid
CID 63651571
3-bromo-N-(cyclopropylmethyl)-N-propan-2-ylthiophene-2-carboxamide
CID 60783055

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide (CID 113224073) is N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide is CC(C)N(CC1CC1)C(=O)c1ccn(C)c(=O)c1.
What is the InChIKey of N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide?
The InChIKey is CCOKHAPGESZVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(2)16(9-11-4-5-11)14(18)12-6-7-15(3)13(17)8-12/h6-8,10-11H,4-5,9H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide?
N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.65, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-1-methyl-2-oxo-N-propan-2-ylpyridine-4-carboxamide is sourced from PubChem (CID 113224073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).