4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide

C22H24N4O2 — CID 50828302

IUPAC4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc2ncn(C3CCN(C(=O)Nc4ccccc4C)CC3)c(=O)c2c1
InChIInChI=1S/C22H24N4O2/c1-15-7-8-20-18(13-15)21(27)26(14-23-20)17-9-11-25(12-10-17)22(28)24-19-6-4-3-5-16(19)2/h3-8,13-14,17H,9-12H2,1-2H3,(H,24,28)
InChIKeyZUFROUWCMKHRRY-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.88
Rot. Bonds2

About 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide

4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide (PubChem CID 50828302) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
PubChem CID50828302
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
SMILESCc1ccc2ncn(C3CCN(C(=O)Nc4ccccc4C)CC3)c(=O)c2c1
InChIInChI=1S/C22H24N4O2/c1-15-7-8-20-18(13-15)21(27)26(14-23-20)17-9-11-25(12-10-17)22(28)24-19-6-4-3-5-16(19)2/h3-8,13-14,17H,9-12H2,1-2H3,(H,24,28)
InChIKeyZUFROUWCMKHRRY-UHFFFAOYSA-N
XLogP3.88
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-4-methylphenyl)-4-(6-methyl-4-oxoquinazolin-3-yl)piperidine-1-carboxamide
CID 50828397
4-(4-oxoquinazolin-3-yl)-N-phenylpiperidine-1-carboxamide
CID 46344313
4-(7-chloro-4-oxoquinazolin-3-yl)-N-(2-ethoxyphenyl)piperidine-1-carboxamide
CID 50828166
N-(2,3-dimethylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286518
4-(6-chloro-4-oxoquinazolin-3-yl)-N-(4-methoxyphenyl)piperidine-1-carboxamide
CID 50828339
N-(5-chloro-2-methylphenyl)-4-imidazo[4,5-b]pyridin-3-ylpiperidine-1-carboxamide
CID 46286530
N-(4-fluorophenyl)-4-(8-methyl-4-oxoquinazolin-3-yl)piperidine-1-carboxamide
CID 50828300
3-(azetidin-3-yl)-6-methylquinazolin-4-one
CID 117263880
4-(2-methylimidazo[4,5-b]pyridin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide
CID 46286561
3-[1-(4,5-diethoxy-2-nitrobenzoyl)piperidin-4-yl]-6-methylquinazolin-4-one
CID 139907076
N-cyclohexyl-4-(5-methylbenzimidazol-1-yl)piperidine-1-carboxamide
CID 71468764
N-(2,5-dimethylphenyl)-4-(4-pyridin-2-yltriazol-1-yl)piperidine-1-carboxamide
CID 46992891

Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide?
The IUPAC name of 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide (CID 50828302) is 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide is Cc1ccc2ncn(C3CCN(C(=O)Nc4ccccc4C)CC3)c(=O)c2c1.
What is the InChIKey of 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide?
The InChIKey is ZUFROUWCMKHRRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-15-7-8-20-18(13-15)21(27)26(14-23-20)17-9-11-25(12-10-17)22(28)24-19-6-4-3-5-16(19)2/h3-8,13-14,17H,9-12H2,1-2H3,(H,24,28).
What are the key properties of 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide?
4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-4-oxoquinazolin-3-yl)-N-(2-methylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 50828302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).