(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine

C10H19N — CID 178028785

IUPAC(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine
SMILESCCC/C=C/C(C)=C\N(C)C
InChIInChI=1S/C10H19N/c1-5-6-7-8-10(2)9-11(3)4/h7-9H,5-6H2,1-4H3/b8-7+,10-9-
InChIKeyYCUGYRIATAASIZ-GOJKSUSPSA-N
MW153.27 g/mol
LogP2.81
Rot. Bonds4

About (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine

(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine (PubChem CID 178028785) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine.

Molecular Properties

Compound Name(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine
PubChem CID178028785
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine
SMILESCCC/C=C/C(C)=C\N(C)C
InChIInChI=1S/C10H19N/c1-5-6-7-8-10(2)9-11(3)4/h7-9H,5-6H2,1-4H3/b8-7+,10-9-
InChIKeyYCUGYRIATAASIZ-GOJKSUSPSA-N
XLogP2.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (1Z,3E)-N,N,2-trimethylhepta-1,3-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

(3E)-2-methylhepta-1,3-diene
CID 12928201
2-methylhepta-1,3-diene
CID 54310621
(4E,7E)-undeca-4,7-dien-6-one
CID 23366329
(E)-hex-2-enoic acid
CID 5282707
N-chlorohex-2-enamide;N,N-dimethylmethanamine
CID 172860490
(3E,5Z)-nona-3,5-dien-4-amine
CID 146251565
(2E,4Z)-octa-2,4-dien-3-ol
CID 144538239
docosakis(hex-2-enoic acid);phosphane
CID 174896095
CID 165146612
CID 165146612
(2E,4E)-3-methylnona-2,4-dienoic acid
CID 87750367
(2Z,4E)-4-methylocta-2,4-dien-1-amine
CID 55285493
(3E)-4-methyldeca-3,5-diene
CID 173452678

Frequently Asked Questions

What is the IUPAC name of (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine?
The IUPAC name of (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine (CID 178028785) is (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine.
What is the SMILES notation for (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine?
The canonical SMILES for (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine is CCC/C=C/C(C)=C\N(C)C.
What is the InChIKey of (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine?
The InChIKey is YCUGYRIATAASIZ-GOJKSUSPSA-N. The full InChI is InChI=1S/C10H19N/c1-5-6-7-8-10(2)9-11(3)4/h7-9H,5-6H2,1-4H3/b8-7+,10-9-.
What are the key properties of (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine?
(1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine has a molecular weight of 153.27 g/mol, XLogP of 2.81, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z,3E)-N,N,2-trimethylhepta-1,3-dien-1-amine is sourced from PubChem (CID 178028785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).