1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide

C15H19N5O — CID 64590092

IUPAC1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1ncnc2ccc(N)cc12
InChIInChI=1S/C15H19N5O/c1-9-2-3-10(14(17)21)7-20(9)15-12-6-11(16)4-5-13(12)18-8-19-15/h4-6,8-10H,2-3,7,16H2,1H3,(H2,17,21)
InChIKeyABECXFSUPWWCQK-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.30
Rot. Bonds2

About 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide

1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide (PubChem CID 64590092) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide
PubChem CID64590092
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide
SMILESCC1CCC(C(N)=O)CN1c1ncnc2ccc(N)cc12
InChIInChI=1S/C15H19N5O/c1-9-2-3-10(14(17)21)7-20(9)15-12-6-11(16)4-5-13(12)18-8-19-15/h4-6,8-10H,2-3,7,16H2,1H3,(H2,17,21)
InChIKeyABECXFSUPWWCQK-UHFFFAOYSA-N
XLogP1.30
TPSA98.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-(2-methylazepan-1-yl)quinazolin-6-amine
CID 64589320
1-(4-amino-2-fluorophenyl)-6-methylpiperidine-3-carboxamide
CID 54989494
1-(6-chloro-5-ethylpyrimidin-4-yl)-6-methylpiperidine-3-carboxamide
CID 55229121
1-(3-amino-6-methyl-2-pyridinyl)-6-methylpiperidine-3-carboxamide
CID 81131851
1-(6-aminoquinazolin-4-yl)-3-methylpiperidin-4-ol
CID 114677655
1-(6-chloro-5-propylpyrimidin-4-yl)-6-methylpiperidine-3-carboxamide
CID 63729313
[1-(6-aminoquinazolin-4-yl)azepan-2-yl]methanol
CID 116633942
(3S,6S)-1-(4-bromo-2-pyridinyl)-6-methylpiperidine-3-carboxamide
CID 99857715
4-(5-carbamoyl-2-methylpiperidin-1-yl)pyridine-2-carboxylic acid
CID 54988866
4-(4-ethylpiperidin-1-yl)quinazolin-6-amine
CID 64589288
1-(6-methoxyquinazolin-4-yl)piperidine-4-carboxamide
CID 21002803
1-(2-amino-4-iodophenyl)-6-methylpiperidine-3-carboxamide
CID 66064522

Frequently Asked Questions

What is the IUPAC name of 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide (CID 64590092) is 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide is CC1CCC(C(N)=O)CN1c1ncnc2ccc(N)cc12.
What is the InChIKey of 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide?
The InChIKey is ABECXFSUPWWCQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-9-2-3-10(14(17)21)7-20(9)15-12-6-11(16)4-5-13(12)18-8-19-15/h4-6,8-10H,2-3,7,16H2,1H3,(H2,17,21).
What are the key properties of 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide?
1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-aminoquinazolin-4-yl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 64590092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).