(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine

C15H31N — CID 167068493

IUPAC(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine
SMILESCC(C)N(C)CC/C=C\CCCC(C)(C)C
InChIInChI=1S/C15H31N/c1-14(2)16(6)13-11-9-7-8-10-12-15(3,4)5/h7,9,14H,8,10-13H2,1-6H3/b9-7-
InChIKeyZVKHRIBEEIDOBH-CLFYSBASSA-N
MW225.42 g/mol
LogP4.49
Rot. Bonds7

About (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine

(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine (PubChem CID 167068493) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine.

Molecular Properties

Compound Name(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine
PubChem CID167068493
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC Name(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine
SMILESCC(C)N(C)CC/C=C\CCCC(C)(C)C
InChIInChI=1S/C15H31N/c1-14(2)16(6)13-11-9-7-8-10-12-15(3,4)5/h7,9,14H,8,10-13H2,1-6H3/b9-7-
InChIKeyZVKHRIBEEIDOBH-CLFYSBASSA-N
XLogP4.49
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.49
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 (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-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 (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine?
The IUPAC name of (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine (CID 167068493) is (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine.
What is the SMILES notation for (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine?
The canonical SMILES for (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine is CC(C)N(C)CC/C=C\CCCC(C)(C)C.
What is the InChIKey of (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine?
The InChIKey is ZVKHRIBEEIDOBH-CLFYSBASSA-N. The full InChI is InChI=1S/C15H31N/c1-14(2)16(6)13-11-9-7-8-10-12-15(3,4)5/h7,9,14H,8,10-13H2,1-6H3/b9-7-.
What are the key properties of (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine?
(Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine has a molecular weight of 225.42 g/mol, XLogP of 4.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N,8,8-trimethyl-N-propan-2-ylnon-3-en-1-amine is sourced from PubChem (CID 167068493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).