N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide

C16H17N3O2 — CID 118741508

IUPACN-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCC2c2ccccc2)ccc1=O
InChIInChI=1S/C16H17N3O2/c1-18-11-13(7-8-15(18)20)17-16(21)19-10-9-14(19)12-5-3-2-4-6-12/h2-8,11,14H,9-10H2,1H3,(H,17,21)
InChIKeyGEYZSIFGYUZJJM-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.36
Rot. Bonds2

About N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide

N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide (PubChem CID 118741508) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide
PubChem CID118741508
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC NameN-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide
SMILESCn1cc(NC(=O)N2CCC2c2ccccc2)ccc1=O
InChIInChI=1S/C16H17N3O2/c1-18-11-13(7-8-15(18)20)17-16(21)19-10-9-14(19)12-5-3-2-4-6-12/h2-8,11,14H,9-10H2,1H3,(H,17,21)
InChIKeyGEYZSIFGYUZJJM-UHFFFAOYSA-N
XLogP2.36
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Mavacamten
CID 117761397
1-benzyl-6-methylpyrimidine-2,4(1H,3H)-dione
CID 309331
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CID 237962
5-(1-Phenyl-ethylamino)-1H-pyrimidine-2,4-dione
CID 3161634
N-((2-hydroxy-4,6-dimethylpyridin-3-yl)methyl)-2-oxo-1-(1-phenylethyl)-1,2-dihydropyridine-4-carboxamide
CID 71571201
1-benzyl-5-N-cyclobutyl-3-N-methyl-2-oxopyridine-3,5-dicarboxamide
CID 126648780
1-benzyl-3-N-methyl-2-oxo-5-N-propan-2-ylpyridine-3,5-dicarboxamide
CID 135341830
6-[[benzyl(cyclopropyl)amino]methyl]-1H-pyrimidine-2,4-dione
CID 75460034
6-Benzyl-1-butyl-5-ethyluracil
CID 460917
1-(1-Benzyl-2-oxo-1,2-dihydro-pyridin-3-yl)-3-cyclohexyl-urea
CID 1450035
1-Cyclohexyl-3-[1-(4-fluoro-benzyl)-2-oxo-1,2-dihydro-pyridin-3-yl]-urea
CID 1450067
1-Cyclohexyl-3-[1-(4-methyl-benzyl)-2-oxo-1,2-dihydro-pyridin-3-yl]-urea
CID 1450086

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide?
The IUPAC name of N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide (CID 118741508) is N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide is Cn1cc(NC(=O)N2CCC2c2ccccc2)ccc1=O.
What is the InChIKey of N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide?
The InChIKey is GEYZSIFGYUZJJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-18-11-13(7-8-15(18)20)17-16(21)19-10-9-14(19)12-5-3-2-4-6-12/h2-8,11,14H,9-10H2,1H3,(H,17,21).
What are the key properties of N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide?
N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide has a molecular weight of 283.33 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxo-3-pyridinyl)-2-phenylazetidine-1-carboxamide is sourced from PubChem (CID 118741508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).