7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine

C19H25FN4O — CID 121255066

IUPAC7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
SMILESCc1cc2c(NC3CCC(N4CCOCC4)CC3)ncnc2cc1F
InChIInChI=1S/C19H25FN4O/c1-13-10-16-18(11-17(13)20)21-12-22-19(16)23-14-2-4-15(5-3-14)24-6-8-25-9-7-24/h10-12,14-15H,2-9H2,1H3,(H,21,22,23)
InChIKeyMYESWKIVNUJYDN-UHFFFAOYSA-N
MW344.43 g/mol
LogP3.13
Rot. Bonds3

About 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine

7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine (PubChem CID 121255066) has the molecular formula C19H25FN4O and a molecular weight of 344.43 g/mol. Its IUPAC name is 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine.

Molecular Properties

Compound Name7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
PubChem CID121255066
Molecular FormulaC19H25FN4O
Molecular Weight344.43 g/mol
Exact Mass344.20
IUPAC Name7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
SMILESCc1cc2c(NC3CCC(N4CCOCC4)CC3)ncnc2cc1F
InChIInChI=1S/C19H25FN4O/c1-13-10-16-18(11-17(13)20)21-12-22-19(16)23-14-2-4-15(5-3-14)24-6-8-25-9-7-24/h10-12,14-15H,2-9H2,1H3,(H,21,22,23)
InChIKeyMYESWKIVNUJYDN-UHFFFAOYSA-N
XLogP3.13
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The IUPAC name of 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine (CID 121255066) is 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine.
What is the SMILES notation for 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The canonical SMILES for 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine is Cc1cc2c(NC3CCC(N4CCOCC4)CC3)ncnc2cc1F.
What is the InChIKey of 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
The InChIKey is MYESWKIVNUJYDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4O/c1-13-10-16-18(11-17(13)20)21-12-22-19(16)23-14-2-4-15(5-3-14)24-6-8-25-9-7-24/h10-12,14-15H,2-9H2,1H3,(H,21,22,23).
What are the key properties of 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine?
7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine has a molecular weight of 344.43 g/mol, XLogP of 3.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine is sourced from PubChem (CID 121255066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).