(Z)-N,2-dimethylhex-3-en-3-amine

C8H17N — CID 170980731

IUPAC(Z)-N,2-dimethylhex-3-en-3-amine
SMILESCC/C=C(\NC)C(C)C
InChIInChI=1S/C8H17N/c1-5-6-8(9-4)7(2)3/h6-7,9H,5H2,1-4H3/b8-6-
InChIKeyVISJNIQNTJMVHZ-VURMDHGXSA-N
MW127.23 g/mol
LogP2.16
Rot. Bonds3

About (Z)-N,2-dimethylhex-3-en-3-amine

(Z)-N,2-dimethylhex-3-en-3-amine (PubChem CID 170980731) has the molecular formula C8H17N and a molecular weight of 127.23 g/mol. Its IUPAC name is (Z)-N,2-dimethylhex-3-en-3-amine.

Molecular Properties

Compound Name(Z)-N,2-dimethylhex-3-en-3-amine
PubChem CID170980731
Molecular FormulaC8H17N
Molecular Weight127.23 g/mol
Exact Mass127.14
IUPAC Name(Z)-N,2-dimethylhex-3-en-3-amine
SMILESCC/C=C(\NC)C(C)C
InChIInChI=1S/C8H17N/c1-5-6-8(9-4)7(2)3/h6-7,9H,5H2,1-4H3/b8-6-
InChIKeyVISJNIQNTJMVHZ-VURMDHGXSA-N
XLogP2.16
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.23
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (Z)-N,2-dimethylhex-3-en-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 (Z)-N,2-dimethylhex-3-en-3-amine?
The IUPAC name of (Z)-N,2-dimethylhex-3-en-3-amine (CID 170980731) is (Z)-N,2-dimethylhex-3-en-3-amine.
What is the SMILES notation for (Z)-N,2-dimethylhex-3-en-3-amine?
The canonical SMILES for (Z)-N,2-dimethylhex-3-en-3-amine is CC/C=C(\NC)C(C)C.
What is the InChIKey of (Z)-N,2-dimethylhex-3-en-3-amine?
The InChIKey is VISJNIQNTJMVHZ-VURMDHGXSA-N. The full InChI is InChI=1S/C8H17N/c1-5-6-8(9-4)7(2)3/h6-7,9H,5H2,1-4H3/b8-6-.
What are the key properties of (Z)-N,2-dimethylhex-3-en-3-amine?
(Z)-N,2-dimethylhex-3-en-3-amine has a molecular weight of 127.23 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,2-dimethylhex-3-en-3-amine is sourced from PubChem (CID 170980731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).