1-(3-methylphenyl)cyclopropane-1-carbohydrazide

C11H14N2O — CID 116844219

IUPAC1-(3-methylphenyl)cyclopropane-1-carbohydrazide
SMILESCc1cccc(C2(C(=O)NN)CC2)c1
InChIInChI=1S/C11H14N2O/c1-8-3-2-4-9(7-8)11(5-6-11)10(14)13-12/h2-4,7H,5-6,12H2,1H3,(H,13,14)
InChIKeyZIEYODZLYZAXRG-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.02
Rot. Bonds2

About 1-(3-methylphenyl)cyclopropane-1-carbohydrazide

1-(3-methylphenyl)cyclopropane-1-carbohydrazide (PubChem CID 116844219) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-(3-methylphenyl)cyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name1-(3-methylphenyl)cyclopropane-1-carbohydrazide
PubChem CID116844219
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name1-(3-methylphenyl)cyclopropane-1-carbohydrazide
SMILESCc1cccc(C2(C(=O)NN)CC2)c1
InChIInChI=1S/C11H14N2O/c1-8-3-2-4-9(7-8)11(5-6-11)10(14)13-12/h2-4,7H,5-6,12H2,1H3,(H,13,14)
InChIKeyZIEYODZLYZAXRG-UHFFFAOYSA-N
XLogP1.02
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.02
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

methyl 1-(3-methylphenyl)cyclopropane-1-carboxylate
CID 105444214
1-[1-(3-methylphenyl)cyclopropyl]butan-1-one
CID 142382203
N-(2-chloroprop-2-enyl)-1-(3-methylphenyl)cyclobutane-1-carboxamide
CID 113238634
1-(3-bromophenyl)cyclohexane-1-carbohydrazide
CID 116844534
1-[1-(3-methylphenyl)cyclopropanecarbonyl]-4-phenylpiperidine-4-carboxylic acid
CID 119168328
1-(3-methylphenyl)cyclopent-3-ene-1-carboxylic acid
CID 65353598
methyl 1-(3-methylphenyl)cyclobutane-1-carboxylate
CID 112724218
1-(3,4-dimethylphenyl)cyclohexane-1-carbohydrazide
CID 116844496
N-(2-hydroxy-2-methylpropyl)-1-(3-methylphenyl)cyclobutane-1-carboxamide
CID 65109762
N-[(1-hydroxycyclobutyl)methyl]-1-(3-methylphenyl)cyclopentane-1-carboxamide
CID 111445825
N-[(3R,4S)-4-hydroxyoxolan-3-yl]-1-(3-methylphenyl)cyclopentane-1-carboxamide
CID 128649441
1-[[[1-(3-methylphenyl)cyclobutanecarbonyl]amino]methyl]cyclopropane-1-carboxylic acid
CID 115449997

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylphenyl)cyclopropane-1-carbohydrazide?
The IUPAC name of 1-(3-methylphenyl)cyclopropane-1-carbohydrazide (CID 116844219) is 1-(3-methylphenyl)cyclopropane-1-carbohydrazide.
What is the SMILES notation for 1-(3-methylphenyl)cyclopropane-1-carbohydrazide?
The canonical SMILES for 1-(3-methylphenyl)cyclopropane-1-carbohydrazide is Cc1cccc(C2(C(=O)NN)CC2)c1.
What is the InChIKey of 1-(3-methylphenyl)cyclopropane-1-carbohydrazide?
The InChIKey is ZIEYODZLYZAXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-8-3-2-4-9(7-8)11(5-6-11)10(14)13-12/h2-4,7H,5-6,12H2,1H3,(H,13,14).
What are the key properties of 1-(3-methylphenyl)cyclopropane-1-carbohydrazide?
1-(3-methylphenyl)cyclopropane-1-carbohydrazide has a molecular weight of 190.25 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methylphenyl)cyclopropane-1-carbohydrazide is sourced from PubChem (CID 116844219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).