1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide

C13H17ClN2O2 — CID 116847330

IUPAC1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide
SMILESCNNC(=O)C1(c2cc(Cl)cc(C)c2OC)CC1
InChIInChI=1S/C13H17ClN2O2/c1-8-6-9(14)7-10(11(8)18-3)13(4-5-13)12(17)16-15-2/h6-7,15H,4-5H2,1-3H3,(H,16,17)
InChIKeyRXQZZAKBMBYXGJ-UHFFFAOYSA-N
MW268.74 g/mol
LogP1.94
Rot. Bonds4

About 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide

1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide (PubChem CID 116847330) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide
PubChem CID116847330
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC Name1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide
SMILESCNNC(=O)C1(c2cc(Cl)cc(C)c2OC)CC1
InChIInChI=1S/C13H17ClN2O2/c1-8-6-9(14)7-10(11(8)18-3)13(4-5-13)12(17)16-15-2/h6-7,15H,4-5H2,1-3H3,(H,16,17)
InChIKeyRXQZZAKBMBYXGJ-UHFFFAOYSA-N
XLogP1.94
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-methyl-1-(2,4,5-trimethylphenyl)cyclopropane-1-carbohydrazide
CID 116847331
1-(5-chloro-2,3-dimethoxyphenyl)cyclopropane-1-carboxylic acid
CID 117394916
1-(4-methoxy-2,3,6-trimethylphenyl)-N'-methylcyclopropane-1-carbohydrazide
CID 116847386
2-[1-(5-chloro-2-methoxy-3-methylphenyl)cyclopropyl]acetic acid
CID 117389898
1-(5-chloro-2-methoxy-3-methylphenyl)cyclobutan-1-amine
CID 117324614
1-(5-chloro-3-methoxy-2-propan-2-yloxyphenyl)cyclopentane-1-carboxylic acid
CID 117497834
1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide
CID 116847276
1-(5-fluoro-2-methoxy-3-methylphenyl)cyclohexane-1-carboxylic acid
CID 117419827
N'-methyl-1-naphthalen-1-ylcyclopropane-1-carbohydrazide
CID 116847393
1-(3-chloro-2-methoxy-4,6-dimethylphenyl)cyclopropane-1-carboxylic acid
CID 117389831
N-(4-chloro-2-methylphenyl)-1-(2-methoxyphenyl)cyclopropane-1-carboxamide
CID 110438923
[1-(aminomethyl)cyclopropyl]-(5-chloro-2-methoxy-3-methylphenyl)methanone
CID 116921253

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The IUPAC name of 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide (CID 116847330) is 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide.
What is the SMILES notation for 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The canonical SMILES for 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide is CNNC(=O)C1(c2cc(Cl)cc(C)c2OC)CC1.
What is the InChIKey of 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The InChIKey is RXQZZAKBMBYXGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c1-8-6-9(14)7-10(11(8)18-3)13(4-5-13)12(17)16-15-2/h6-7,15H,4-5H2,1-3H3,(H,16,17).
What are the key properties of 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide?
1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide has a molecular weight of 268.74 g/mol, XLogP of 1.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-methoxy-3-methylphenyl)-N'-methylcyclopropane-1-carbohydrazide is sourced from PubChem (CID 116847330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).