N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide

C20H23N3O — CID 45214726

IUPACN-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCc2nc(-c3ccccc3)ncc21)C1CCCC1
InChIInChI=1S/C20H23N3O/c24-20(15-9-4-5-10-15)23-18-12-6-11-17-16(18)13-21-19(22-17)14-7-2-1-3-8-14/h1-3,7-8,13,15,18H,4-6,9-12H2,(H,23,24)
InChIKeyRGLCFUPJIUVVAV-UHFFFAOYSA-N
MW321.42 g/mol
LogP3.83
Rot. Bonds3

About N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide

N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide (PubChem CID 45214726) has the molecular formula C20H23N3O and a molecular weight of 321.42 g/mol. Its IUPAC name is N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide.

Molecular Properties

Compound NameN-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
PubChem CID45214726
Molecular FormulaC20H23N3O
Molecular Weight321.42 g/mol
Exact Mass321.18
IUPAC NameN-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide
SMILESO=C(NC1CCCc2nc(-c3ccccc3)ncc21)C1CCCC1
InChIInChI=1S/C20H23N3O/c24-20(15-9-4-5-10-15)23-18-12-6-11-17-16(18)13-21-19(22-17)14-7-2-1-3-8-14/h1-3,7-8,13,15,18H,4-6,9-12H2,(H,23,24)
InChIKeyRGLCFUPJIUVVAV-UHFFFAOYSA-N
XLogP3.83
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5S)-2-pyridin-3-yl-5,6,7,8-tetrahydroquinazolin-5-yl]cyclobutanecarboxamide
CID 25379238
N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)pyridine-4-carboxamide
CID 56731433
N-[(5S)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]but-2-ynamide
CID 26404996
3-methyl-N-[(5S)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]butanamide
CID 25454443
N-[(5S)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]pyrazine-2-carboxamide
CID 95384867
2-(2-methoxyethoxy)-N-[(5R)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
CID 97127538
2-(furan-2-yl)-2-oxo-N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)acetamide
CID 45251959
2-(2-methoxyphenyl)-N-[(5S)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]acetamide
CID 25453314
2,5-dimethyl-N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)pyrazole-3-carboxamide
CID 56731428
3-(methanesulfonamido)-N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)propanamide
CID 72860377
N-[(5R)-2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl]pyrrolidine-1-sulfonamide
CID 97129063
(2R)-2-phenyl-N-[(5S)-2-pyridin-4-yl-5,6,7,8-tetrahydroquinazolin-5-yl]propanamide
CID 92582688

Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The IUPAC name of N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide (CID 45214726) is N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide.
What is the SMILES notation for N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The canonical SMILES for N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide is O=C(NC1CCCc2nc(-c3ccccc3)ncc21)C1CCCC1.
What is the InChIKey of N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
The InChIKey is RGLCFUPJIUVVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O/c24-20(15-9-4-5-10-15)23-18-12-6-11-17-16(18)13-21-19(22-17)14-7-2-1-3-8-14/h1-3,7-8,13,15,18H,4-6,9-12H2,(H,23,24).
What are the key properties of N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide?
N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide has a molecular weight of 321.42 g/mol, XLogP of 3.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-5,6,7,8-tetrahydroquinazolin-5-yl)cyclopentanecarboxamide is sourced from PubChem (CID 45214726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).