1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide

C27H28N4O — CID 26275494

IUPAC1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide
SMILESCc1nc(N2CCC(C(=O)NCCc3ccc4ccccc4c3)CC2)nc2ccccc12
InChIInChI=1S/C27H28N4O/c1-19-24-8-4-5-9-25(24)30-27(29-19)31-16-13-22(14-17-31)26(32)28-15-12-20-10-11-21-6-2-3-7-23(21)18-20/h2-11,18,22H,12-17H2,1H3,(H,28,32)
InChIKeyKJRBRNDLZXFLGN-UHFFFAOYSA-N
MW424.55 g/mol
LogP4.67
Rot. Bonds5

About 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide

1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide (PubChem CID 26275494) has the molecular formula C27H28N4O and a molecular weight of 424.55 g/mol. Its IUPAC name is 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide
PubChem CID26275494
Molecular FormulaC27H28N4O
Molecular Weight424.55 g/mol
Exact Mass424.23
IUPAC Name1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide
SMILESCc1nc(N2CCC(C(=O)NCCc3ccc4ccccc4c3)CC2)nc2ccccc12
InChIInChI=1S/C27H28N4O/c1-19-24-8-4-5-9-25(24)30-27(29-19)31-16-13-22(14-17-31)26(32)28-15-12-20-10-11-21-6-2-3-7-23(21)18-20/h2-11,18,22H,12-17H2,1H3,(H,28,32)
InChIKeyKJRBRNDLZXFLGN-UHFFFAOYSA-N
XLogP4.67
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.55
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[(1R,5S)-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]ethyl]-1-(4-methylquinazolin-2-yl)piperidine-4-carboxamide
CID 42379160
N-[2-[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]ethyl]-1-(4-methylquinazolin-2-yl)piperidine-4-carboxamide
CID 28811940
N-(2-phenylethyl)-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 1442082
1-(4-methyl-7-methylsulfonylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidin-4-amine
CID 42455266
N-[2-(2-fluorophenyl)ethyl]-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide
CID 42438176
1-(4,6-dimethylpyrimidin-2-yl)-N-[2-(1-methylbenzimidazol-2-yl)ethyl]piperidine-4-carboxamide
CID 71710226
1-(4-methylquinazolin-2-yl)-N-[[(1R,2R,4S)-spiro[bicyclo[2.2.1]hept-5-ene-7,1'-cyclopropane]-2-yl]methyl]piperidine-4-carboxamide
CID 98586407
1-(4,6-dimethylpyrimidin-2-yl)-N-[2-(2-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 650826
1-(4,7-dimethylquinazolin-2-yl)-N-[(4-phenyloxan-4-yl)methyl]piperidine-4-carboxamide
CID 42246429
N-[2-(3-fluorophenyl)ethyl]-1-(1-methylbenzimidazol-2-yl)piperidine-4-carboxamide
CID 16675649
N-butyl-1-(4-methyl-7-methylsulfonylquinazolin-2-yl)piperidine-4-carboxamide
CID 42452627
N-[2-(4-chlorophenyl)ethyl]-1-pyrimidin-2-ylpiperidine-4-carboxamide
CID 1442114

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide?
The IUPAC name of 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide (CID 26275494) is 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide is Cc1nc(N2CCC(C(=O)NCCc3ccc4ccccc4c3)CC2)nc2ccccc12.
What is the InChIKey of 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide?
The InChIKey is KJRBRNDLZXFLGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N4O/c1-19-24-8-4-5-9-25(24)30-27(29-19)31-16-13-22(14-17-31)26(32)28-15-12-20-10-11-21-6-2-3-7-23(21)18-20/h2-11,18,22H,12-17H2,1H3,(H,28,32).
What are the key properties of 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide?
1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide has a molecular weight of 424.55 g/mol, XLogP of 4.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylquinazolin-2-yl)-N-(2-naphthalen-2-ylethyl)piperidine-4-carboxamide is sourced from PubChem (CID 26275494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).