2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide

C15H20N2O3 — CID 109133160

IUPAC2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide
SMILESCOCCCNC(=O)C1CC1C(=O)Nc1ccccc1
InChIInChI=1S/C15H20N2O3/c1-20-9-5-8-16-14(18)12-10-13(12)15(19)17-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyFFMVPXOOCGVFNT-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.41
Rot. Bonds7

About 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide

2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide (PubChem CID 109133160) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide
PubChem CID109133160
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide
SMILESCOCCCNC(=O)C1CC1C(=O)Nc1ccccc1
InChIInChI=1S/C15H20N2O3/c1-20-9-5-8-16-14(18)12-10-13(12)15(19)17-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3,(H,16,18)(H,17,19)
InChIKeyFFMVPXOOCGVFNT-UHFFFAOYSA-N
XLogP1.41
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-N-(3-methoxypropyl)-1-N-(4-methylphenyl)cyclopropane-1,2-dicarboxamide
CID 109133163
1-N-(3-bromophenyl)-2-N-(3-methoxypropyl)cyclopropane-1,2-dicarboxamide
CID 109133234
1-N-(4-ethoxyphenyl)-2-N-(3-methoxypropyl)cyclopropane-1,2-dicarboxamide
CID 109133203
1-N-(2,6-dichlorophenyl)-2-N-(3-methoxypropyl)cyclopropane-1,2-dicarboxamide
CID 109133253
2-N-(3-methoxypropyl)-1-N-(2-propan-2-ylphenyl)cyclopropane-1,2-dicarboxamide
CID 109133177
2-N-[2-(dimethylamino)ethyl]-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109133706
2-N-[2-(2-methoxyphenyl)ethyl]-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109137821
N-(3-methoxypropyl)-N'-phenyloxamide
CID 3437698
N-(3-methoxypropyl)-4-[(2-methylcyclopropanecarbonyl)amino]benzamide
CID 46437430
1-N-(3-cyanophenyl)-2-N-(2-methoxyethyl)cyclopropane-1,2-dicarboxamide
CID 109133078
2-N-[(4-methoxyphenyl)methyl]-1-N-phenylcyclopropane-1,2-dicarboxamide
CID 109136562
1-N-[2-(4-fluorophenyl)ethyl]-2-N-(3-methoxypropyl)cyclopropane-1,2-dicarboxamide
CID 109133116

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide?
The IUPAC name of 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide (CID 109133160) is 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide.
What is the SMILES notation for 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide?
The canonical SMILES for 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide is COCCCNC(=O)C1CC1C(=O)Nc1ccccc1.
What is the InChIKey of 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide?
The InChIKey is FFMVPXOOCGVFNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-20-9-5-8-16-14(18)12-10-13(12)15(19)17-11-6-3-2-4-7-11/h2-4,6-7,12-13H,5,8-10H2,1H3,(H,16,18)(H,17,19).
What are the key properties of 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide?
2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide has a molecular weight of 276.34 g/mol, XLogP of 1.41, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-methoxypropyl)-1-N-phenylcyclopropane-1,2-dicarboxamide is sourced from PubChem (CID 109133160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).