(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one

C19H21N3O — CID 7342529

IUPAC(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
SMILESO=C1C[C@H](c2ccccc2)Cc2nc(NC3CCCC3)ncc21
InChIInChI=1S/C19H21N3O/c23-18-11-14(13-6-2-1-3-7-13)10-17-16(18)12-20-19(22-17)21-15-8-4-5-9-15/h1-3,6-7,12,14-15H,4-5,8-11H2,(H,20,21,22)/t14-/m1/s1
InChIKeyVSOCYTSVRVJJPD-CQSZACIVSA-N
MW307.40 g/mol
LogP3.74
Rot. Bonds3

About (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one

(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one (PubChem CID 7342529) has the molecular formula C19H21N3O and a molecular weight of 307.40 g/mol. Its IUPAC name is (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one.

Molecular Properties

Compound Name(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
PubChem CID7342529
Molecular FormulaC19H21N3O
Molecular Weight307.40 g/mol
Exact Mass307.17
IUPAC Name(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
SMILESO=C1C[C@H](c2ccccc2)Cc2nc(NC3CCCC3)ncc21
InChIInChI=1S/C19H21N3O/c23-18-11-14(13-6-2-1-3-7-13)10-17-16(18)12-20-19(22-17)21-15-8-4-5-9-15/h1-3,6-7,12,14-15H,4-5,8-11H2,(H,20,21,22)/t14-/m1/s1
InChIKeyVSOCYTSVRVJJPD-CQSZACIVSA-N
XLogP3.74
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

7-(2-chlorophenyl)-2-(cyclopropylamino)-7,8-dihydro-6H-quinazolin-5-one
CID 2945963
(7R)-2-(benzylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
CID 713042
(7R)-2-amino-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
CID 738767
2-methyl-N-[(7S)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]benzamide
CID 7354569
N-[(7S)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]furan-2-carboxamide
CID 940577
N-[(7S)-7-(4-tert-butylphenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]benzamide
CID 2044089
3-chloro-N-[(7R)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]benzamide
CID 2016919
2-[(4,8-dimethylquinazolin-2-yl)amino]-7-phenyl-7,8-dihydro-6H-quinazolin-5-one
CID 3161010
2-(4-chlorophenyl)sulfanyl-N-[(7S)-5-oxo-7-phenyl-7,8-dihydro-6H-quinazolin-2-yl]acetamide
CID 1491873
N-[(7S)-7-(4-chlorophenyl)-5-oxo-7,8-dihydro-6H-quinazolin-2-yl]acetamide
CID 831476
N-[(7R)-5-oxo-7-(4-propan-2-ylphenyl)-7,8-dihydro-6H-quinazolin-2-yl]-2-phenylacetamide
CID 2021087
2-(benzylamino)-7-(2-methylphenyl)-7,8-dihydro-6H-quinazolin-5-one
CID 16584123

Frequently Asked Questions

What is the IUPAC name of (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one?
The IUPAC name of (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one (CID 7342529) is (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one.
What is the SMILES notation for (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one?
The canonical SMILES for (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one is O=C1C[C@H](c2ccccc2)Cc2nc(NC3CCCC3)ncc21.
What is the InChIKey of (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one?
The InChIKey is VSOCYTSVRVJJPD-CQSZACIVSA-N. The full InChI is InChI=1S/C19H21N3O/c23-18-11-14(13-6-2-1-3-7-13)10-17-16(18)12-20-19(22-17)21-15-8-4-5-9-15/h1-3,6-7,12,14-15H,4-5,8-11H2,(H,20,21,22)/t14-/m1/s1.
What are the key properties of (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one?
(7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one has a molecular weight of 307.40 g/mol, XLogP of 3.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7R)-2-(cyclopentylamino)-7-phenyl-7,8-dihydro-6H-quinazolin-5-one is sourced from PubChem (CID 7342529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).