3-amino-4-oxo-N-phenylazetidine-2-carboxamide

C10H11N3O2 — CID 14230695

IUPAC3-amino-4-oxo-N-phenylazetidine-2-carboxamide
SMILESNC1C(=O)NC1C(=O)Nc1ccccc1
InChIInChI=1S/C10H11N3O2/c11-7-8(13-9(7)14)10(15)12-6-4-2-1-3-5-6/h1-5,7-8H,11H2,(H,12,15)(H,13,14)
InChIKeyCLXODERGBZVCPL-UHFFFAOYSA-N
MW205.22 g/mol
LogP-0.55
Rot. Bonds2

About 3-amino-4-oxo-N-phenylazetidine-2-carboxamide

3-amino-4-oxo-N-phenylazetidine-2-carboxamide (PubChem CID 14230695) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 3-amino-4-oxo-N-phenylazetidine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-oxo-N-phenylazetidine-2-carboxamide
PubChem CID14230695
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name3-amino-4-oxo-N-phenylazetidine-2-carboxamide
SMILESNC1C(=O)NC1C(=O)Nc1ccccc1
InChIInChI=1S/C10H11N3O2/c11-7-8(13-9(7)14)10(15)12-6-4-2-1-3-5-6/h1-5,7-8H,11H2,(H,12,15)(H,13,14)
InChIKeyCLXODERGBZVCPL-UHFFFAOYSA-N
XLogP-0.55
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-oxo-N-phenyl-1,3-dihydroindole-3-carboxamide
CID 134112326
trans-(1R,2R)-2-amino-N-phenylcyclohexane-1-carboxamide
CID 10889384
trans-(1R,2R)-1-N,2-N-diphenylcyclohexane-1,2-dicarboxamide
CID 15685590
2,5-dioxo-N-phenylcyclopentane-1-carboxamide
CID 75388196
3-hydroxy-5-oxo-N-phenyl-1,2-oxazolidine-4-carboxamide
CID 142439146
4-N-(4-fluorophenyl)-1-N-phenylcyclohexane-1,4-dicarboxamide
CID 109150302
N-(4-fluorophenyl)-2-oxo-5-phenyl-1,3-oxazolidine-4-carboxamide
CID 110689144
molecular hydrogen;phenylurea
CID 143657584
6-oxo-N-phenyldiazinane-3-carboxamide
CID 78211041
(1S,2S,3S,4R)-3-(phenylcarbamoyl)bicyclo[2.2.1]heptane-2-carboxylic acid
CID 1216637
2-anilino-N-phenylcyclohexane-1-carboxamide
CID 12512570
3-amino-N-[4-(phenylcarbamoyl)phenyl]bicyclo[2.2.1]heptane-2-carboxamide
CID 119756435

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-oxo-N-phenylazetidine-2-carboxamide?
The IUPAC name of 3-amino-4-oxo-N-phenylazetidine-2-carboxamide (CID 14230695) is 3-amino-4-oxo-N-phenylazetidine-2-carboxamide.
What is the SMILES notation for 3-amino-4-oxo-N-phenylazetidine-2-carboxamide?
The canonical SMILES for 3-amino-4-oxo-N-phenylazetidine-2-carboxamide is NC1C(=O)NC1C(=O)Nc1ccccc1.
What is the InChIKey of 3-amino-4-oxo-N-phenylazetidine-2-carboxamide?
The InChIKey is CLXODERGBZVCPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c11-7-8(13-9(7)14)10(15)12-6-4-2-1-3-5-6/h1-5,7-8H,11H2,(H,12,15)(H,13,14).
What are the key properties of 3-amino-4-oxo-N-phenylazetidine-2-carboxamide?
3-amino-4-oxo-N-phenylazetidine-2-carboxamide has a molecular weight of 205.22 g/mol, XLogP of -0.55, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-oxo-N-phenylazetidine-2-carboxamide is sourced from PubChem (CID 14230695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).