N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide

C17H18N2O2 — CID 94001737

IUPACN-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)cc1=O
InChIInChI=1S/C17H18N2O2/c1-19-10-9-14(11-15(19)20)17(21)18-16(13-7-8-13)12-5-3-2-4-6-12/h2-6,9-11,13,16H,7-8H2,1H3,(H,18,21)/t16-/m0/s1
InChIKeySBXZUUQKIRONTI-INIZCTEOSA-N
MW282.34 g/mol
LogP2.27
Rot. Bonds4

About N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide

N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 94001737) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID94001737
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC NameN-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)cc1=O
InChIInChI=1S/C17H18N2O2/c1-19-10-9-14(11-15(19)20)17(21)18-16(13-7-8-13)12-5-3-2-4-6-12/h2-6,9-11,13,16H,7-8H2,1H3,(H,18,21)/t16-/m0/s1
InChIKeySBXZUUQKIRONTI-INIZCTEOSA-N
XLogP2.27
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 75460706
N-[(S)-(4-fluorophenyl)-phenylmethyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 94044299
N-[(4-chlorophenyl)-cyclopropylmethyl]benzamide
CID 17494418
1-methyl-2-oxo-N-[(R)-phenyl(pyridin-2-yl)methyl]pyridine-4-carboxamide
CID 94001377
N-[cyclopropyl-(4-methoxyphenyl)methyl]benzamide
CID 46566275
4-(bromomethyl)-N-[cyclopropyl(phenyl)methyl]benzamide
CID 102850932
4-bromo-N-[cyclopropyl(phenyl)methyl]-3-(dimethylsulfamoyl)benzamide
CID 43037303
N-[cyclopropyl(phenyl)methyl]-1,3-dimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-6-carboxamide
CID 42939132
1-methyl-N-[(2R)-3-methyl-3-phenylbutan-2-yl]-2-oxopyridine-4-carboxamide
CID 95301985
4,5-dibromo-N-[cyclopropyl(phenyl)methyl]thiophene-2-carboxamide
CID 112723097
1-methyl-2-oxo-N-[(1S)-2-(2-oxopyrrolidin-1-yl)-1-phenylethyl]pyridine-4-carboxamide
CID 94029267
N-[cyclopropyl(phenyl)methyl]-2-methylbenzamide
CID 51295877

Frequently Asked Questions

What is the IUPAC name of N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide (CID 94001737) is N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)cc1=O.
What is the InChIKey of N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is SBXZUUQKIRONTI-INIZCTEOSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-19-10-9-14(11-15(19)20)17(21)18-16(13-7-8-13)12-5-3-2-4-6-12/h2-6,9-11,13,16H,7-8H2,1H3,(H,18,21)/t16-/m0/s1.
What are the key properties of N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide?
N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 282.34 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(R)-cyclopropyl(phenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 94001737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).