N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide

C14H20N2O — CID 125464208

IUPACN'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide
SMILESCC(=O)NN[C@@H]1CCC[C@H]1Cc1ccccc1
InChIInChI=1S/C14H20N2O/c1-11(17)15-16-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h2-4,6-7,13-14,16H,5,8-10H2,1H3,(H,15,17)/t13-,14+/m0/s1
InChIKeyVFDSSXRHCWLFPJ-UONOGXRCSA-N
MW232.33 g/mol
LogP2.04
Rot. Bonds4

About N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide

N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide (PubChem CID 125464208) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide.

Molecular Properties

Compound NameN'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide
PubChem CID125464208
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide
SMILESCC(=O)NN[C@@H]1CCC[C@H]1Cc1ccccc1
InChIInChI=1S/C14H20N2O/c1-11(17)15-16-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h2-4,6-7,13-14,16H,5,8-10H2,1H3,(H,15,17)/t13-,14+/m0/s1
InChIKeyVFDSSXRHCWLFPJ-UONOGXRCSA-N
XLogP2.04
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-[(1S,2S)-2-benzylcyclohexyl]acetohydrazide
CID 125464130
N-[2-[[(1S,2S)-2-benzylcyclopentyl]amino]ethyl]acetamide
CID 99579151
2-[[(1S,2R)-2-benzylcyclopentyl]amino]acetonitrile
CID 99792150
N-(2-benzylcyclohexyl)-2,2-difluoroacetamide
CID 167792579
4-amino-N-(2-benzylcyclopentyl)pentanamide;hydrochloride
CID 120563001
3-amino-N-(2-benzylcyclohexyl)butanamide
CID 119773392
(2R)-N-[(1R,2R)-2-benzylcyclohexyl]-2-methylsulfonylpropanamide
CID 96532946
3-[(2-benzylcyclopentyl)carbamoyl-methylamino]-2-methylpropanoic acid
CID 122002977
4-(aminomethyl)-N-(2-benzylcyclopentyl)benzamide;hydrochloride
CID 119329447
4-[(2-benzylcyclopentyl)carbamoylamino]butanoic acid
CID 122002966
N-(2-benzylcyclopentyl)pyrrolidine-3-carboxamide
CID 119794025
trans-(1S,2S)-N-methyl-2-[(4-phenylmethoxyphenyl)methyl]cyclopentan-1-amine
CID 67573261

Frequently Asked Questions

What is the IUPAC name of N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide?
The IUPAC name of N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide (CID 125464208) is N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide.
What is the SMILES notation for N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide?
The canonical SMILES for N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide is CC(=O)NN[C@@H]1CCC[C@H]1Cc1ccccc1.
What is the InChIKey of N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide?
The InChIKey is VFDSSXRHCWLFPJ-UONOGXRCSA-N. The full InChI is InChI=1S/C14H20N2O/c1-11(17)15-16-14-9-5-8-13(14)10-12-6-3-2-4-7-12/h2-4,6-7,13-14,16H,5,8-10H2,1H3,(H,15,17)/t13-,14+/m0/s1.
What are the key properties of N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide?
N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide has a molecular weight of 232.33 g/mol, XLogP of 2.04, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[(1R,2S)-2-benzylcyclopentyl]acetohydrazide is sourced from PubChem (CID 125464208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).