(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide

C19H24N4O — CID 96566820

IUPAC(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide
SMILESCc1cccc2ncnc(N3CCC[C@@H](C(=O)NCC4CC4)C3)c12
InChIInChI=1S/C19H24N4O/c1-13-4-2-6-16-17(13)18(22-12-21-16)23-9-3-5-15(11-23)19(24)20-10-14-7-8-14/h2,4,6,12,14-15H,3,5,7-11H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeySCNRBYQIOMCNAD-OAHLLOKOSA-N
MW324.43 g/mol
LogP2.68
Rot. Bonds4

About (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide

(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide (PubChem CID 96566820) has the molecular formula C19H24N4O and a molecular weight of 324.43 g/mol. Its IUPAC name is (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide
PubChem CID96566820
Molecular FormulaC19H24N4O
Molecular Weight324.43 g/mol
Exact Mass324.20
IUPAC Name(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide
SMILESCc1cccc2ncnc(N3CCC[C@@H](C(=O)NCC4CC4)C3)c12
InChIInChI=1S/C19H24N4O/c1-13-4-2-6-16-17(13)18(22-12-21-16)23-9-3-5-15(11-23)19(24)20-10-14-7-8-14/h2,4,6,12,14-15H,3,5,7-11H2,1H3,(H,20,24)/t15-/m1/s1
InChIKeySCNRBYQIOMCNAD-OAHLLOKOSA-N
XLogP2.68
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.43
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-chloro-4-methyl-2-pyridinyl)-N-(cyclopropylmethyl)piperidine-3-carboxamide
CID 75457578
N-(2-hydroxyethyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 110436254
N-butyl-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 49431629
1-quinazolin-4-yl-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 133326896
(3S)-N-(cyclopropylmethyl)-1-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperidine-3-carboxamide
CID 97076436
1-(5-piperidin-1-ylquinazolin-4-yl)piperidine-3-carboxylic acid
CID 134220212
methyl 1-[5-(3,5-dimethylpiperidin-1-yl)quinazolin-4-yl]piperidine-3-carboxylate
CID 134211180
3-[1-[5-(3,5-dimethylphenyl)quinazolin-4-yl]piperidin-3-yl]-3-oxopropanoic acid
CID 142278514
(3S)-1-(5-fluoroquinazolin-4-yl)piperidine-3-carboxamide
CID 94519630
N-butyl-1-(6-methylquinazolin-4-yl)piperidine-3-carboxamide
CID 133278233
N-(3-formamidopropyl)-1-quinazolin-4-ylpiperidine-3-carboxamide
CID 110436261
tert-butyl N-[[1-(5-methylquinazolin-4-yl)piperidin-2-yl]methyl]carbamate
CID 133397040

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide (CID 96566820) is (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide is Cc1cccc2ncnc(N3CCC[C@@H](C(=O)NCC4CC4)C3)c12.
What is the InChIKey of (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide?
The InChIKey is SCNRBYQIOMCNAD-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H24N4O/c1-13-4-2-6-16-17(13)18(22-12-21-16)23-9-3-5-15(11-23)19(24)20-10-14-7-8-14/h2,4,6,12,14-15H,3,5,7-11H2,1H3,(H,20,24)/t15-/m1/s1.
What are the key properties of (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide?
(3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide has a molecular weight of 324.43 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(cyclopropylmethyl)-1-(5-methylquinazolin-4-yl)piperidine-3-carboxamide is sourced from PubChem (CID 96566820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).