N-ethenyl-N,4-dimethylheptan-1-amine

C11H23N — CID 123346281

IUPACN-ethenyl-N,4-dimethylheptan-1-amine
SMILESC=CN(C)CCCC(C)CCC
InChIInChI=1S/C11H23N/c1-5-8-11(3)9-7-10-12(4)6-2/h6,11H,2,5,7-10H2,1,3-4H3
InChIKeyUQKIIMCORYGHDQ-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.28
Rot. Bonds7

About N-ethenyl-N,4-dimethylheptan-1-amine

N-ethenyl-N,4-dimethylheptan-1-amine (PubChem CID 123346281) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-ethenyl-N,4-dimethylheptan-1-amine.

Molecular Properties

Compound NameN-ethenyl-N,4-dimethylheptan-1-amine
PubChem CID123346281
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-ethenyl-N,4-dimethylheptan-1-amine
SMILESC=CN(C)CCCC(C)CCC
InChIInChI=1S/C11H23N/c1-5-8-11(3)9-7-10-12(4)6-2/h6,11H,2,5,7-10H2,1,3-4H3
InChIKeyUQKIIMCORYGHDQ-UHFFFAOYSA-N
XLogP3.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N-ethenyl-N,4-dimethylheptan-1-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-ethenyl-N,4-dimethylheptan-1-amine?
The IUPAC name of N-ethenyl-N,4-dimethylheptan-1-amine (CID 123346281) is N-ethenyl-N,4-dimethylheptan-1-amine.
What is the SMILES notation for N-ethenyl-N,4-dimethylheptan-1-amine?
The canonical SMILES for N-ethenyl-N,4-dimethylheptan-1-amine is C=CN(C)CCCC(C)CCC.
What is the InChIKey of N-ethenyl-N,4-dimethylheptan-1-amine?
The InChIKey is UQKIIMCORYGHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-5-8-11(3)9-7-10-12(4)6-2/h6,11H,2,5,7-10H2,1,3-4H3.
What are the key properties of N-ethenyl-N,4-dimethylheptan-1-amine?
N-ethenyl-N,4-dimethylheptan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 3.28, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N,4-dimethylheptan-1-amine is sourced from PubChem (CID 123346281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).