N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide

C14H17N3O2 — CID 117060839

IUPACN-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1)NNC1=CCCC1
InChIInChI=1S/C14H17N3O2/c18-13(17-16-12-8-4-5-9-12)10-15-14(19)11-6-2-1-3-7-11/h1-3,6-8,16H,4-5,9-10H2,(H,15,19)(H,17,18)
InChIKeyQAKVABVQPZSZHE-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.11
Rot. Bonds5

About N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide

N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide (PubChem CID 117060839) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide
PubChem CID117060839
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC NameN-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide
SMILESO=C(CNC(=O)c1ccccc1)NNC1=CCCC1
InChIInChI=1S/C14H17N3O2/c18-13(17-16-12-8-4-5-9-12)10-15-14(19)11-6-2-1-3-7-11/h1-3,6-8,16H,4-5,9-10H2,(H,15,19)(H,17,18)
InChIKeyQAKVABVQPZSZHE-UHFFFAOYSA-N
XLogP1.11
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-(cyclohexen-1-yl)-2-phenoxyacetohydrazide
CID 4621301
N'-(cyclopenten-1-yl)-2-(2-phenylphenoxy)acetohydrazide
CID 2367765
N-[2-(cyclopropylmethylamino)-2-oxoethyl]benzamide
CID 25469630
N-[2-(2-benzoylhydrazinyl)-2-oxoethyl]-4-chlorobenzamide
CID 9414874
N'-(cyclohexen-1-yl)-2-(4-methylanilino)acetohydrazide
CID 5077247
2-(3-bromoanilino)-N'-(cyclohexen-1-yl)acetohydrazide
CID 4983930
N'-(cyclohexen-1-yl)-2-hydroxybenzohydrazide
CID 4231723
N-[2-[[2-[4-[[2-[(2-benzamidoacetyl)amino]acetyl]amino]butylamino]-2-oxoethyl]amino]-2-oxoethyl]benzamide
CID 101335616
2-[(2-benzamidoacetyl)amino]propanedioic acid
CID 44626300
2-benzamidoacetic acid;hydrofluoride
CID 174760685
N-[2-[(1-hydroxycyclobutyl)methylamino]-2-oxoethyl]benzamide
CID 111539734
N-[2-(cyclobutene-1-carbonylamino)ethyl]benzamide
CID 75440243

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide (CID 117060839) is N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide is O=C(CNC(=O)c1ccccc1)NNC1=CCCC1.
What is the InChIKey of N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide?
The InChIKey is QAKVABVQPZSZHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c18-13(17-16-12-8-4-5-9-12)10-15-14(19)11-6-2-1-3-7-11/h1-3,6-8,16H,4-5,9-10H2,(H,15,19)(H,17,18).
What are the key properties of N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide?
N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide has a molecular weight of 259.31 g/mol, XLogP of 1.11, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(cyclopenten-1-yl)hydrazinyl]-2-oxoethyl]benzamide is sourced from PubChem (CID 117060839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).