N-decyl-1,5-dimethylpyrrolidin-3-amine

C16H34N2 — CID 81467256

IUPACN-decyl-1,5-dimethylpyrrolidin-3-amine
SMILESCCCCCCCCCCNC1CC(C)N(C)C1
InChIInChI=1S/C16H34N2/c1-4-5-6-7-8-9-10-11-12-17-16-13-15(2)18(3)14-16/h15-17H,4-14H2,1-3H3
InChIKeyNZLQHEZGFATAQX-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.81
Rot. Bonds10

About N-decyl-1,5-dimethylpyrrolidin-3-amine

N-decyl-1,5-dimethylpyrrolidin-3-amine (PubChem CID 81467256) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is N-decyl-1,5-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound NameN-decyl-1,5-dimethylpyrrolidin-3-amine
PubChem CID81467256
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC NameN-decyl-1,5-dimethylpyrrolidin-3-amine
SMILESCCCCCCCCCCNC1CC(C)N(C)C1
InChIInChI=1S/C16H34N2/c1-4-5-6-7-8-9-10-11-12-17-16-13-15(2)18(3)14-16/h15-17H,4-14H2,1-3H3
InChIKeyNZLQHEZGFATAQX-UHFFFAOYSA-N
XLogP3.81
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-decyl-1,5-dimethylpyrrolidin-3-amine 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-decyl-1,5-dimethylpyrrolidin-3-amine?
The IUPAC name of N-decyl-1,5-dimethylpyrrolidin-3-amine (CID 81467256) is N-decyl-1,5-dimethylpyrrolidin-3-amine.
What is the SMILES notation for N-decyl-1,5-dimethylpyrrolidin-3-amine?
The canonical SMILES for N-decyl-1,5-dimethylpyrrolidin-3-amine is CCCCCCCCCCNC1CC(C)N(C)C1.
What is the InChIKey of N-decyl-1,5-dimethylpyrrolidin-3-amine?
The InChIKey is NZLQHEZGFATAQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-4-5-6-7-8-9-10-11-12-17-16-13-15(2)18(3)14-16/h15-17H,4-14H2,1-3H3.
What are the key properties of N-decyl-1,5-dimethylpyrrolidin-3-amine?
N-decyl-1,5-dimethylpyrrolidin-3-amine has a molecular weight of 254.46 g/mol, XLogP of 3.81, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-decyl-1,5-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 81467256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).