2-amino-N-cyclohexylquinazoline-4-carboxamide

C15H18N4O — CID 24749596

IUPAC2-amino-N-cyclohexylquinazoline-4-carboxamide
SMILESNc1nc(C(=O)NC2CCCCC2)c2ccccc2n1
InChIInChI=1S/C15H18N4O/c16-15-18-12-9-5-4-8-11(12)13(19-15)14(20)17-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,17,20)(H2,16,18,19)
InChIKeyMKJXRVYJTXHGCE-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.27
Rot. Bonds2

About 2-amino-N-cyclohexylquinazoline-4-carboxamide

2-amino-N-cyclohexylquinazoline-4-carboxamide (PubChem CID 24749596) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-amino-N-cyclohexylquinazoline-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-cyclohexylquinazoline-4-carboxamide
PubChem CID24749596
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-amino-N-cyclohexylquinazoline-4-carboxamide
SMILESNc1nc(C(=O)NC2CCCCC2)c2ccccc2n1
InChIInChI=1S/C15H18N4O/c16-15-18-12-9-5-4-8-11(12)13(19-15)14(20)17-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,17,20)(H2,16,18,19)
InChIKeyMKJXRVYJTXHGCE-UHFFFAOYSA-N
XLogP2.27
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-methylquinazoline-4-carboxamide
CID 110702850
N-cycloheptyl-7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxamide
CID 2451567
4-N-cyclooctylquinazoline-2,4-diamine
CID 80786546
5-amino-N-cyclohexyl-1-phenyltriazole-4-carboxamide
CID 6498288
N-cyclopentyl-2-oxo-1H-quinazoline-4-carboxamide
CID 110702489
2-amino-N-[2-(4-fluorophenyl)ethyl]quinazoline-4-carboxamide
CID 68506824
N-cyclooctyl-3-methyl-2-phenylquinoline-4-carboxamide
CID 4122728
N-cyclooctylquinoxaline-2-carboxamide
CID 22136387
(2R)-N-cycloheptyl-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxamide
CID 7886798
N-cyclohexyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 757634
1-amino-N-cyclopentylisoquinoline-4-carboxamide
CID 106770096
2-[1-(cycloheptylamino)-1-oxopropan-2-yl]sulfanyl-N-cyclopropylquinoline-4-carboxamide
CID 46647045

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclohexylquinazoline-4-carboxamide?
The IUPAC name of 2-amino-N-cyclohexylquinazoline-4-carboxamide (CID 24749596) is 2-amino-N-cyclohexylquinazoline-4-carboxamide.
What is the SMILES notation for 2-amino-N-cyclohexylquinazoline-4-carboxamide?
The canonical SMILES for 2-amino-N-cyclohexylquinazoline-4-carboxamide is Nc1nc(C(=O)NC2CCCCC2)c2ccccc2n1.
What is the InChIKey of 2-amino-N-cyclohexylquinazoline-4-carboxamide?
The InChIKey is MKJXRVYJTXHGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c16-15-18-12-9-5-4-8-11(12)13(19-15)14(20)17-10-6-2-1-3-7-10/h4-5,8-10H,1-3,6-7H2,(H,17,20)(H2,16,18,19).
What are the key properties of 2-amino-N-cyclohexylquinazoline-4-carboxamide?
2-amino-N-cyclohexylquinazoline-4-carboxamide has a molecular weight of 270.34 g/mol, XLogP of 2.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclohexylquinazoline-4-carboxamide is sourced from PubChem (CID 24749596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).