2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide

C19H21N5O2 — CID 144899681

IUPAC2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide
SMILESNN/C=C(\N)C1CC(=O)N1C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21N5O2/c20-15(12-22-21)16-11-17(25)24(16)19(26)23-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,16,18,22H,11,20-21H2,(H,23,26)/b15-12-
InChIKeyFALISZLBKTWBNQ-QINSGFPZSA-N
MW351.41 g/mol
LogP1.35
Rot. Bonds5

About 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide

2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide (PubChem CID 144899681) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide.

Molecular Properties

Compound Name2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide
PubChem CID144899681
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide
SMILESNN/C=C(\N)C1CC(=O)N1C(=O)NC(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H21N5O2/c20-15(12-22-21)16-11-17(25)24(16)19(26)23-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,16,18,22H,11,20-21H2,(H,23,26)/b15-12-
InChIKeyFALISZLBKTWBNQ-QINSGFPZSA-N
XLogP1.35
TPSA113.48 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 51.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide;4-methylpyridin-2-amine
CID 144899680
2-[(Z)-1,2-diaminoethenyl]-4-oxo-N-(1-phenylethyl)azetidine-1-carboxamide
CID 174176847
N-benzhydryl-2-(difluoromethyl)-4-oxoazetidine-1-carboxamide
CID 144899971
1-N-benzhydrylpiperidine-1,4-dicarboxamide
CID 108867553
4-oxo-1-(phenylcarbamoyl)azetidine-2-carboxylic acid
CID 68602588
(2S)-4-oxo-1-(phenylcarbamoyl)azetidine-2-carboxylic acid
CID 11951050
2-cyano-4-oxo-N-(1-phenylethyl)azetidine-1-carboxamide
CID 144900037
N-benzhydryl-3-(hydroxymethyl)azetidine-1-carboxamide
CID 121105871
(2R)-2-(2-fluorophenyl)sulfanyl-4-oxo-N-[(1S)-1-phenylethyl]azetidine-1-carboxamide
CID 155560672
N-benzhydryl-3-(2,5-dioxoimidazolidin-1-yl)azetidine-1-carboxamide
CID 121159552
(3S)-N-benzhydryl-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9400697
5-N-benzhydryl-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide
CID 46577919

Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide?
The IUPAC name of 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide (CID 144899681) is 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide.
What is the SMILES notation for 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide?
The canonical SMILES for 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide is NN/C=C(\N)C1CC(=O)N1C(=O)NC(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide?
The InChIKey is FALISZLBKTWBNQ-QINSGFPZSA-N. The full InChI is InChI=1S/C19H21N5O2/c20-15(12-22-21)16-11-17(25)24(16)19(26)23-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,12,16,18,22H,11,20-21H2,(H,23,26)/b15-12-.
What are the key properties of 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide?
2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 1.35, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-1-amino-2-hydrazinylethenyl]-N-benzhydryl-4-oxoazetidine-1-carboxamide is sourced from PubChem (CID 144899681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).