1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide

C15H21NO3 — CID 110485708

IUPAC1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide
SMILESCOCCCNC(=O)C1(c2ccc(OC)cc2)CC1
InChIInChI=1S/C15H21NO3/c1-18-11-3-10-16-14(17)15(8-9-15)12-4-6-13(19-2)7-5-12/h4-7H,3,8-11H2,1-2H3,(H,16,17)
InChIKeyUFPQJVDDAIIBLK-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.88
Rot. Bonds7

About 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide

1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide (PubChem CID 110485708) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide
PubChem CID110485708
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC Name1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide
SMILESCOCCCNC(=O)C1(c2ccc(OC)cc2)CC1
InChIInChI=1S/C15H21NO3/c1-18-11-3-10-16-14(17)15(8-9-15)12-4-6-13(19-2)7-5-12/h4-7H,3,8-11H2,1-2H3,(H,16,17)
InChIKeyUFPQJVDDAIIBLK-UHFFFAOYSA-N
XLogP1.88
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide (CID 110485708) is 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide is COCCCNC(=O)C1(c2ccc(OC)cc2)CC1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide?
The InChIKey is UFPQJVDDAIIBLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-18-11-3-10-16-14(17)15(8-9-15)12-4-6-13(19-2)7-5-12/h4-7H,3,8-11H2,1-2H3,(H,16,17).
What are the key properties of 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide?
1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-(3-methoxypropyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 110485708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).