1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide

C12H16N2O2 — CID 116847276

IUPAC1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide
SMILESCNNC(=O)C1(c2ccc(OC)cc2)CC1
InChIInChI=1S/C12H16N2O2/c1-13-14-11(15)12(7-8-12)9-3-5-10(16-2)6-4-9/h3-6,13H,7-8H2,1-2H3,(H,14,15)
InChIKeySTDDWWAZSIFQDA-UHFFFAOYSA-N
MW220.27 g/mol
LogP0.98
Rot. Bonds4

About 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide

1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide (PubChem CID 116847276) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide
PubChem CID116847276
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide
SMILESCNNC(=O)C1(c2ccc(OC)cc2)CC1
InChIInChI=1S/C12H16N2O2/c1-13-14-11(15)12(7-8-12)9-3-5-10(16-2)6-4-9/h3-6,13H,7-8H2,1-2H3,(H,14,15)
InChIKeySTDDWWAZSIFQDA-UHFFFAOYSA-N
XLogP0.98
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(4-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
CID 53016794
N'-methyl-1-(6-methylnaphthalen-2-yl)cyclopropane-1-carbohydrazide
CID 116847390
N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 110485718
N-cycloheptyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 113198451
N-ethyl-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 110487274
N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)cyclopropane-1-carboxamide
CID 113198206
1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide
CID 110485708
4-(4-methoxyphenyl)-N-methylbicyclo[2.2.2]octane-1-carboxamide
CID 146623691
N-[2-[[1-(4-chlorophenyl)cyclopropanecarbonyl]amino]ethyl]-4-methoxybenzamide
CID 55878815
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 113198536
N-(2,5-dimethylphenyl)-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 113198467
1-(4-methoxyphenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 113198528

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The IUPAC name of 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide (CID 116847276) is 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide.
What is the SMILES notation for 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The canonical SMILES for 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide is CNNC(=O)C1(c2ccc(OC)cc2)CC1.
What is the InChIKey of 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide?
The InChIKey is STDDWWAZSIFQDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-13-14-11(15)12(7-8-12)9-3-5-10(16-2)6-4-9/h3-6,13H,7-8H2,1-2H3,(H,14,15).
What are the key properties of 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide?
1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide has a molecular weight of 220.27 g/mol, XLogP of 0.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide is sourced from PubChem (CID 116847276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).