N,N-dimethyldec-1-en-5-amine

C12H25N — CID 170848017

IUPACN,N-dimethyldec-1-en-5-amine
SMILESC=CCCC(CCCCC)N(C)C
InChIInChI=1S/C12H25N/c1-5-7-9-11-12(13(3)4)10-8-6-2/h6,12H,2,5,7-11H2,1,3-4H3
InChIKeyYKIMVFUHRVNLPJ-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.46
Rot. Bonds8

About N,N-dimethyldec-1-en-5-amine

N,N-dimethyldec-1-en-5-amine (PubChem CID 170848017) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is N,N-dimethyldec-1-en-5-amine.

Molecular Properties

Compound NameN,N-dimethyldec-1-en-5-amine
PubChem CID170848017
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC NameN,N-dimethyldec-1-en-5-amine
SMILESC=CCCC(CCCCC)N(C)C
InChIInChI=1S/C12H25N/c1-5-7-9-11-12(13(3)4)10-8-6-2/h6,12H,2,5,7-11H2,1,3-4H3
InChIKeyYKIMVFUHRVNLPJ-UHFFFAOYSA-N
XLogP3.46
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-dimethyldec-1-en-5-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,N-dimethyldec-1-en-5-amine?
The IUPAC name of N,N-dimethyldec-1-en-5-amine (CID 170848017) is N,N-dimethyldec-1-en-5-amine.
What is the SMILES notation for N,N-dimethyldec-1-en-5-amine?
The canonical SMILES for N,N-dimethyldec-1-en-5-amine is C=CCCC(CCCCC)N(C)C.
What is the InChIKey of N,N-dimethyldec-1-en-5-amine?
The InChIKey is YKIMVFUHRVNLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-5-7-9-11-12(13(3)4)10-8-6-2/h6,12H,2,5,7-11H2,1,3-4H3.
What are the key properties of N,N-dimethyldec-1-en-5-amine?
N,N-dimethyldec-1-en-5-amine has a molecular weight of 183.34 g/mol, XLogP of 3.46, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyldec-1-en-5-amine is sourced from PubChem (CID 170848017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).