N,N,5,6,7-pentamethylocta-2,4-dien-1-amine

C13H25N — CID 123622566

IUPACN,N,5,6,7-pentamethylocta-2,4-dien-1-amine
SMILESCC(=CC=CCN(C)C)C(C)C(C)C
InChIInChI=1S/C13H25N/c1-11(2)13(4)12(3)9-7-8-10-14(5)6/h7-9,11,13H,10H2,1-6H3
InChIKeyJMDWQMGPKXKSOG-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.34
Rot. Bonds5

About N,N,5,6,7-pentamethylocta-2,4-dien-1-amine

N,N,5,6,7-pentamethylocta-2,4-dien-1-amine (PubChem CID 123622566) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is N,N,5,6,7-pentamethylocta-2,4-dien-1-amine.

Molecular Properties

Compound NameN,N,5,6,7-pentamethylocta-2,4-dien-1-amine
PubChem CID123622566
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC NameN,N,5,6,7-pentamethylocta-2,4-dien-1-amine
SMILESCC(=CC=CCN(C)C)C(C)C(C)C
InChIInChI=1S/C13H25N/c1-11(2)13(4)12(3)9-7-8-10-14(5)6/h7-9,11,13H,10H2,1-6H3
InChIKeyJMDWQMGPKXKSOG-UHFFFAOYSA-N
XLogP3.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N,5,6,7-pentamethylocta-2,4-dien-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

Related Compounds

(4Z)-4-[(E)-1-fluoroprop-1-enyl]-N,N-dimethyl-3-propan-2-ylhepta-4,6-dien-2-amine
CID 126490053
N,N-Dimethyl-3-(2,6,6-trimethylcyclohex-2-en-1-yl)prop-2-en-1-amine
CID 53439371
(E)-N,N-dimethyl-3-(2,6,6-trimethylcyclohex-2-en-1-yl)prop-2-en-1-amine
CID 90473545
(2E)-N,N-diethyl-3,6-dimethylocta-2,7-dien-1-amine
CID 11435752
(2E)-N,N-diethyl-2,6-dimethylocta-2,7-dien-1-amine
CID 12807205
(1E,3E)-N,N,3,7-tetramethylocta-1,3-dien-1-amine
CID 14543743
(Z)-N,N,4,5-tetramethylhex-2-en-1-amine
CID 15570993
N,N,3,7,11-pentamethyldodeca-2,4,10-trien-1-amine
CID 53692619
N,N,7-triethyl-3,11-dimethyltrideca-2,4,10-trien-1-amine
CID 53697344
N,N,3,7-tetramethylocta-1,3-dien-1-amine
CID 53702615
N,N-diethyl 3,7,11-trimethyldodeca-2,4,10-trienylamine
CID 53837124
N,N-diethyl-3,7,11-trimethyltrideca-2,4,10-trien-1-amine
CID 53979130

Frequently Asked Questions

What is the IUPAC name of N,N,5,6,7-pentamethylocta-2,4-dien-1-amine?
The IUPAC name of N,N,5,6,7-pentamethylocta-2,4-dien-1-amine (CID 123622566) is N,N,5,6,7-pentamethylocta-2,4-dien-1-amine.
What is the SMILES notation for N,N,5,6,7-pentamethylocta-2,4-dien-1-amine?
The canonical SMILES for N,N,5,6,7-pentamethylocta-2,4-dien-1-amine is CC(=CC=CCN(C)C)C(C)C(C)C.
What is the InChIKey of N,N,5,6,7-pentamethylocta-2,4-dien-1-amine?
The InChIKey is JMDWQMGPKXKSOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-11(2)13(4)12(3)9-7-8-10-14(5)6/h7-9,11,13H,10H2,1-6H3.
What are the key properties of N,N,5,6,7-pentamethylocta-2,4-dien-1-amine?
N,N,5,6,7-pentamethylocta-2,4-dien-1-amine has a molecular weight of 195.35 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5,6,7-pentamethylocta-2,4-dien-1-amine is sourced from PubChem (CID 123622566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).