N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide

C15H20N2O4 — CID 26798763

IUPACN'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide
SMILESCOc1ccc(CCC(=O)NNC(=O)C2CC2)cc1OC
InChIInChI=1S/C15H20N2O4/c1-20-12-7-3-10(9-13(12)21-2)4-8-14(18)16-17-15(19)11-5-6-11/h3,7,9,11H,4-6,8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyZEQFUMMZGDJKJP-UHFFFAOYSA-N
MW292.33 g/mol
LogP1.19
Rot. Bonds6

About N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide

N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide (PubChem CID 26798763) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide.

Molecular Properties

Compound NameN'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide
PubChem CID26798763
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC NameN'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide
SMILESCOc1ccc(CCC(=O)NNC(=O)C2CC2)cc1OC
InChIInChI=1S/C15H20N2O4/c1-20-12-7-3-10(9-13(12)21-2)4-8-14(18)16-17-15(19)11-5-6-11/h3,7,9,11H,4-6,8H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyZEQFUMMZGDJKJP-UHFFFAOYSA-N
XLogP1.19
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[3-(3,4-dimethoxyphenyl)propanoylamino]ethyl]cyclohexanecarboxamide
CID 108538969
N-(1-acetylpiperidin-4-yl)-3-(3,4-dimethoxyphenyl)propanamide
CID 51203874
N-(4-aminocyclohexyl)-3-(3,4-dimethoxyphenyl)propanamide
CID 119478687
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145625
3-(3,4-dimethoxyphenyl)-N-propan-2-ylpropanamide
CID 19220709
1-acetyl-N-[2-(3,4-dimethoxyphenyl)ethyl]piperidine-4-carboxamide
CID 6465009
methyl N-[5-(3,4-dimethoxyphenyl)pentanoylamino]carbamate
CID 11001393
N-[1-(2-chlorobenzoyl)piperidin-4-yl]-3-(3,4-dimethoxyphenyl)propanamide
CID 108556459
3-(3,4-dimethoxyphenyl)-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119453910
N-[1-(2-cyanoacetyl)piperidin-4-yl]-3-(3,4-dimethoxyphenyl)propanamide
CID 108556445
4-(3,4-dimethoxyphenyl)-N'-methylbutanehydrazide
CID 116846469
N-cyclopropyl-4-(3,4-dimethoxyphenyl)butanamide
CID 110406403

Frequently Asked Questions

What is the IUPAC name of N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide?
The IUPAC name of N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide (CID 26798763) is N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide.
What is the SMILES notation for N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide?
The canonical SMILES for N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide is COc1ccc(CCC(=O)NNC(=O)C2CC2)cc1OC.
What is the InChIKey of N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide?
The InChIKey is ZEQFUMMZGDJKJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-20-12-7-3-10(9-13(12)21-2)4-8-14(18)16-17-15(19)11-5-6-11/h3,7,9,11H,4-6,8H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide?
N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide has a molecular weight of 292.33 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[3-(3,4-dimethoxyphenyl)propanoyl]cyclopropanecarbohydrazide is sourced from PubChem (CID 26798763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).