2-cyclopropylbenzohydrazide

C10H12N2O — CID 168909064

IUPAC2-cyclopropylbenzohydrazide
SMILESNNC(=O)c1ccccc1C1CC1
InChIInChI=1S/C10H12N2O/c11-12-10(13)9-4-2-1-3-8(9)7-5-6-7/h1-4,7H,5-6,11H2,(H,12,13)
InChIKeyYMTHVGLNYVMEJA-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.17
Rot. Bonds2

About 2-cyclopropylbenzohydrazide

2-cyclopropylbenzohydrazide (PubChem CID 168909064) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-cyclopropylbenzohydrazide.

Molecular Properties

Compound Name2-cyclopropylbenzohydrazide
PubChem CID168909064
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name2-cyclopropylbenzohydrazide
SMILESNNC(=O)c1ccccc1C1CC1
InChIInChI=1S/C10H12N2O/c11-12-10(13)9-4-2-1-3-8(9)7-5-6-7/h1-4,7H,5-6,11H2,(H,12,13)
InChIKeyYMTHVGLNYVMEJA-UHFFFAOYSA-N
XLogP1.17
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentylbenzohydrazide
CID 68852694
2-cyclopropyl-N-phenylbenzamide
CID 71426247
2-cyclopropylbenzoyl chloride
CID 118024624
ethyl 2-cyclopropylbenzoate
CID 118105330
ethyl 3-(2-cyclopropylphenyl)-3-oxopropanoate
CID 170994001
ethyl 4-(2-cyclopropylphenyl)-4-oxobutanoate
CID 79977029
2-[3-[2-(hydrazinecarbonyl)phenyl]-3-oxopropanoyl]benzohydrazide
CID 141301620
2-cyclopropyl-N,N-dimethylbenzamide
CID 144712792
acetic acid;benzene-1,2-dicarbohydrazide
CID 174566374
3-amino-1-(2-cycloheptylphenyl)propan-1-one
CID 117365935
ethyl 2-cyclobutylbenzoate
CID 106942755
2-(4-aminocycloheptyl)benzoic acid
CID 115039628

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylbenzohydrazide?
The IUPAC name of 2-cyclopropylbenzohydrazide (CID 168909064) is 2-cyclopropylbenzohydrazide.
What is the SMILES notation for 2-cyclopropylbenzohydrazide?
The canonical SMILES for 2-cyclopropylbenzohydrazide is NNC(=O)c1ccccc1C1CC1.
What is the InChIKey of 2-cyclopropylbenzohydrazide?
The InChIKey is YMTHVGLNYVMEJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c11-12-10(13)9-4-2-1-3-8(9)7-5-6-7/h1-4,7H,5-6,11H2,(H,12,13).
What are the key properties of 2-cyclopropylbenzohydrazide?
2-cyclopropylbenzohydrazide has a molecular weight of 176.22 g/mol, XLogP of 1.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylbenzohydrazide is sourced from PubChem (CID 168909064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).