8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine

C15H19N3O — CID 11357339

IUPAC8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine
SMILESCOc1cc(C)c2cnc(N)nc2c1C1CCCC1
InChIInChI=1S/C15H19N3O/c1-9-7-12(19-2)13(10-5-3-4-6-10)14-11(9)8-17-15(16)18-14/h7-8,10H,3-6H2,1-2H3,(H2,16,17,18)
InChIKeyJDAVDJXNWHANPO-UHFFFAOYSA-N
MW257.34 g/mol
LogP3.19
Rot. Bonds2

About 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine

8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine (PubChem CID 11357339) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine.

Molecular Properties

Compound Name8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine
PubChem CID11357339
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine
SMILESCOc1cc(C)c2cnc(N)nc2c1C1CCCC1
InChIInChI=1S/C15H19N3O/c1-9-7-12(19-2)13(10-5-3-4-6-10)14-11(9)8-17-15(16)18-14/h7-8,10H,3-6H2,1-2H3,(H2,16,17,18)
InChIKeyJDAVDJXNWHANPO-UHFFFAOYSA-N
XLogP3.19
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine?
The IUPAC name of 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine (CID 11357339) is 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine.
What is the SMILES notation for 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine?
The canonical SMILES for 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine is COc1cc(C)c2cnc(N)nc2c1C1CCCC1.
What is the InChIKey of 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine?
The InChIKey is JDAVDJXNWHANPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-9-7-12(19-2)13(10-5-3-4-6-10)14-11(9)8-17-15(16)18-14/h7-8,10H,3-6H2,1-2H3,(H2,16,17,18).
What are the key properties of 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine?
8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine has a molecular weight of 257.34 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-cyclopentyl-7-methoxy-5-methylquinazolin-2-amine is sourced from PubChem (CID 11357339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).