1-(2-phenylbenzoyl)azetidine-2-carboxamide

C17H16N2O2 — CID 67018285

IUPAC1-(2-phenylbenzoyl)azetidine-2-carboxamide
SMILESNC(=O)C1CCN1C(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C17H16N2O2/c18-16(20)15-10-11-19(15)17(21)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H2,18,20)
InChIKeyIHVWEVMWHJZSCO-UHFFFAOYSA-N
MW280.33 g/mol
LogP2.05
Rot. Bonds3

About 1-(2-phenylbenzoyl)azetidine-2-carboxamide

1-(2-phenylbenzoyl)azetidine-2-carboxamide (PubChem CID 67018285) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 1-(2-phenylbenzoyl)azetidine-2-carboxamide.

Molecular Properties

Compound Name1-(2-phenylbenzoyl)azetidine-2-carboxamide
PubChem CID67018285
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name1-(2-phenylbenzoyl)azetidine-2-carboxamide
SMILESNC(=O)C1CCN1C(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C17H16N2O2/c18-16(20)15-10-11-19(15)17(21)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H2,18,20)
InChIKeyIHVWEVMWHJZSCO-UHFFFAOYSA-N
XLogP2.05
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-carbamoylpyrrolidine-1-carbonyl)benzoic acid
CID 43396532
[2-(aminomethyl)pyrrolidin-1-yl]-(2-phenylphenyl)methanone
CID 134408479
1-(2-fluorobenzoyl)pyrrolidine-2-carboxamide
CID 60659210
(4R)-3-[2-(4-fluorophenyl)benzoyl]-1,3-thiazolidine-4-carboxamide
CID 68590935
(3R)-1,3-dimethyl-4-(2-phenylbenzoyl)piperazin-2-one
CID 95199734
1-[2-[2-amino-4-(1,3-dihydroisoindole-2-carbonyl)quinazolin-6-yl]benzoyl]pyrrolidine-2-carboxamide
CID 67368190
[4-(1-hydroxyethyl)piperidin-1-yl]-(2-phenylphenyl)methanone
CID 111429801
(3-methylpiperidin-1-yl)-(2-phenylphenyl)methanone
CID 145074251
(2-phenylphenyl)-thiomorpholin-4-ylmethanone
CID 47227510
2-carbamoylazetidine-1-carboxylic acid
CID 66897178
(2-phenylphenyl)-pyrrol-1-ylmethanone
CID 166440403
[(4aR,7aS)-1-methyl-6,6-dioxo-2,3,4a,5,7,7a-hexahydrothieno[3,4-b]pyrazin-4-yl]-(2-phenylphenyl)methanone
CID 70712706

Frequently Asked Questions

What is the IUPAC name of 1-(2-phenylbenzoyl)azetidine-2-carboxamide?
The IUPAC name of 1-(2-phenylbenzoyl)azetidine-2-carboxamide (CID 67018285) is 1-(2-phenylbenzoyl)azetidine-2-carboxamide.
What is the SMILES notation for 1-(2-phenylbenzoyl)azetidine-2-carboxamide?
The canonical SMILES for 1-(2-phenylbenzoyl)azetidine-2-carboxamide is NC(=O)C1CCN1C(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of 1-(2-phenylbenzoyl)azetidine-2-carboxamide?
The InChIKey is IHVWEVMWHJZSCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c18-16(20)15-10-11-19(15)17(21)14-9-5-4-8-13(14)12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H2,18,20).
What are the key properties of 1-(2-phenylbenzoyl)azetidine-2-carboxamide?
1-(2-phenylbenzoyl)azetidine-2-carboxamide has a molecular weight of 280.33 g/mol, XLogP of 2.05, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-phenylbenzoyl)azetidine-2-carboxamide is sourced from PubChem (CID 67018285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).