N-ethenyl-N,6-dimethylheptan-2-amine

C11H23N — CID 142908143

IUPACN-ethenyl-N,6-dimethylheptan-2-amine
SMILESC=CN(C)C(C)CCCC(C)C
InChIInChI=1S/C11H23N/c1-6-12(5)11(4)9-7-8-10(2)3/h6,10-11H,1,7-9H2,2-5H3
InChIKeyPPHWPSMXLYBDLN-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.28
Rot. Bonds6

About N-ethenyl-N,6-dimethylheptan-2-amine

N-ethenyl-N,6-dimethylheptan-2-amine (PubChem CID 142908143) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is N-ethenyl-N,6-dimethylheptan-2-amine.

Molecular Properties

Compound NameN-ethenyl-N,6-dimethylheptan-2-amine
PubChem CID142908143
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC NameN-ethenyl-N,6-dimethylheptan-2-amine
SMILESC=CN(C)C(C)CCCC(C)C
InChIInChI=1S/C11H23N/c1-6-12(5)11(4)9-7-8-10(2)3/h6,10-11H,1,7-9H2,2-5H3
InChIKeyPPHWPSMXLYBDLN-UHFFFAOYSA-N
XLogP3.28
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
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,6-dimethylheptan-2-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,6-dimethylheptan-2-amine?
The IUPAC name of N-ethenyl-N,6-dimethylheptan-2-amine (CID 142908143) is N-ethenyl-N,6-dimethylheptan-2-amine.
What is the SMILES notation for N-ethenyl-N,6-dimethylheptan-2-amine?
The canonical SMILES for N-ethenyl-N,6-dimethylheptan-2-amine is C=CN(C)C(C)CCCC(C)C.
What is the InChIKey of N-ethenyl-N,6-dimethylheptan-2-amine?
The InChIKey is PPHWPSMXLYBDLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-6-12(5)11(4)9-7-8-10(2)3/h6,10-11H,1,7-9H2,2-5H3.
What are the key properties of N-ethenyl-N,6-dimethylheptan-2-amine?
N-ethenyl-N,6-dimethylheptan-2-amine has a molecular weight of 169.31 g/mol, XLogP of 3.28, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-N,6-dimethylheptan-2-amine is sourced from PubChem (CID 142908143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).