1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide

C14H20N2O3 — CID 116846077

IUPAC1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide
SMILESCOc1ccc(C2(C(=O)N(C)N)CC2)c(OC)c1C
InChIInChI=1S/C14H20N2O3/c1-9-11(18-3)6-5-10(12(9)19-4)14(7-8-14)13(17)16(2)15/h5-6H,7-8,15H2,1-4H3
InChIKeyLAQQEQNDXWLDSK-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.38
Rot. Bonds4

About 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide

1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide (PubChem CID 116846077) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide.

Molecular Properties

Compound Name1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide
PubChem CID116846077
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide
SMILESCOc1ccc(C2(C(=O)N(C)N)CC2)c(OC)c1C
InChIInChI=1S/C14H20N2O3/c1-9-11(18-3)6-5-10(12(9)19-4)14(7-8-14)13(17)16(2)15/h5-6H,7-8,15H2,1-4H3
InChIKeyLAQQEQNDXWLDSK-UHFFFAOYSA-N
XLogP1.38
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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

1-(4-methoxy-2,3-dimethylphenyl)cyclopropane-1-carbohydrazide
CID 116844174
N-methyl-1-(2-methylphenyl)cyclopropane-1-carbohydrazide
CID 116846113
1-(2,4-dimethoxy-3-methylphenyl)cyclobutan-1-amine
CID 117316614
methyl 1-(2,5-dimethoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylate
CID 116964044
1-(2-ethoxy-3,4-dimethoxyphenyl)cyclopropane-1-carboxylic acid
CID 117419569
N-methyl-1-phenylcyclopropane-1-carbohydrazide
CID 116846008
(2,4-dimethoxy-3-methylphenyl) acetate
CID 10899866
2-methoxy-N,5-dimethylbenzohydrazide
CID 116845575
1-(3-fluoro-2-methoxy-4-methylphenyl)cyclopropane-1-carboxylic acid
CID 117321558
1-(3,4-dimethoxy-2-methylphenyl)cyclopentan-1-amine
CID 117342967
1-(2-hydroxy-3,4-dimethoxyphenyl)cyclobutane-1-carboxylic acid
CID 117383426
1-(2-hydroxy-5-methoxy-3,4-dimethylphenyl)cyclopropane-1-carboxylic acid
CID 117344803

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide?
The IUPAC name of 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide (CID 116846077) is 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide.
What is the SMILES notation for 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide?
The canonical SMILES for 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide is COc1ccc(C2(C(=O)N(C)N)CC2)c(OC)c1C.
What is the InChIKey of 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide?
The InChIKey is LAQQEQNDXWLDSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-9-11(18-3)6-5-10(12(9)19-4)14(7-8-14)13(17)16(2)15/h5-6H,7-8,15H2,1-4H3.
What are the key properties of 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide?
1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide has a molecular weight of 264.32 g/mol, XLogP of 1.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxy-3-methylphenyl)-N-methylcyclopropane-1-carbohydrazide is sourced from PubChem (CID 116846077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).