N-(3-methoxypropyl)cyclohexanecarboxamide

C11H21NO2 — CID 4191027

IUPACN-(3-methoxypropyl)cyclohexanecarboxamide
SMILESCOCCCNC(=O)C1CCCCC1
InChIInChI=1S/C11H21NO2/c1-14-9-5-8-12-11(13)10-6-3-2-4-7-10/h10H,2-9H2,1H3,(H,12,13)
InChIKeyRVEVCAXAWGNUBJ-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.72
Rot. Bonds5

About N-(3-methoxypropyl)cyclohexanecarboxamide

N-(3-methoxypropyl)cyclohexanecarboxamide (PubChem CID 4191027) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is N-(3-methoxypropyl)cyclohexanecarboxamide.

Molecular Properties

Compound NameN-(3-methoxypropyl)cyclohexanecarboxamide
PubChem CID4191027
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC NameN-(3-methoxypropyl)cyclohexanecarboxamide
SMILESCOCCCNC(=O)C1CCCCC1
InChIInChI=1S/C11H21NO2/c1-14-9-5-8-12-11(13)10-6-3-2-4-7-10/h10H,2-9H2,1H3,(H,12,13)
InChIKeyRVEVCAXAWGNUBJ-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-(3-methoxypropyl)cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)cyclohexanecarboxamide?
The IUPAC name of N-(3-methoxypropyl)cyclohexanecarboxamide (CID 4191027) is N-(3-methoxypropyl)cyclohexanecarboxamide.
What is the SMILES notation for N-(3-methoxypropyl)cyclohexanecarboxamide?
The canonical SMILES for N-(3-methoxypropyl)cyclohexanecarboxamide is COCCCNC(=O)C1CCCCC1.
What is the InChIKey of N-(3-methoxypropyl)cyclohexanecarboxamide?
The InChIKey is RVEVCAXAWGNUBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-14-9-5-8-12-11(13)10-6-3-2-4-7-10/h10H,2-9H2,1H3,(H,12,13).
What are the key properties of N-(3-methoxypropyl)cyclohexanecarboxamide?
N-(3-methoxypropyl)cyclohexanecarboxamide has a molecular weight of 199.29 g/mol, XLogP of 1.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)cyclohexanecarboxamide is sourced from PubChem (CID 4191027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).