(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine

C10H19N — CID 156745371

IUPAC(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine
SMILESC/C=C(C)\C=C(\NC)C(C)C
InChIInChI=1S/C10H19N/c1-6-9(4)7-10(11-5)8(2)3/h6-8,11H,1-5H3/b9-6-,10-7+
InChIKeyATRUFHVQHYZYNR-PCCLLEMOSA-N
MW153.27 g/mol
LogP2.71
Rot. Bonds3

About (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine

(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine (PubChem CID 156745371) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine.

Molecular Properties

Compound Name(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine
PubChem CID156745371
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine
SMILESC/C=C(C)\C=C(\NC)C(C)C
InChIInChI=1S/C10H19N/c1-6-9(4)7-10(11-5)8(2)3/h6-8,11H,1-5H3/b9-6-,10-7+
InChIKeyATRUFHVQHYZYNR-PCCLLEMOSA-N
XLogP2.71
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 3742830
(Z)-N,2-dimethylhex-3-en-3-amine
CID 170980731
(Z)-N,2-dimethylhex-3-en-3-amine;ethane
CID 170980730
(2Z,4Z,6Z)-3,4,6-trimethylocta-2,4,6-triene
CID 142039521
(Z)-N,3-dimethyl-1-(propylideneamino)but-1-en-2-amine
CID 169142407
2-bromo-4-methylhexa-2,4-diene
CID 76702782
(2Z,4Z)-4-methylhexa-2,4-dien-2-amine
CID 126728104
(2E,4E)-2-fluoro-4-methylhexa-2,4-diene
CID 143698072
(4Z,10Z)-N,4,5,6,7,8,10-heptamethyldodeca-2,4,6,8,10-pentaen-2-amine
CID 159741743
(3E,5Z)-3-fluoro-2,5-dimethylhepta-1,3,5-triene
CID 142210415
(4Z,6E)-3,5-dimethylocta-2,4,6-triene
CID 144536479
(Z)-N,3,4-trimethylpent-2-en-2-amine
CID 59961887

Frequently Asked Questions

What is the IUPAC name of (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine?
The IUPAC name of (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine (CID 156745371) is (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine.
What is the SMILES notation for (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine?
The canonical SMILES for (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine is C/C=C(C)\C=C(\NC)C(C)C.
What is the InChIKey of (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine?
The InChIKey is ATRUFHVQHYZYNR-PCCLLEMOSA-N. The full InChI is InChI=1S/C10H19N/c1-6-9(4)7-10(11-5)8(2)3/h6-8,11H,1-5H3/b9-6-,10-7+.
What are the key properties of (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine?
(3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine has a molecular weight of 153.27 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3E,5Z)-N,2,5-trimethylhepta-3,5-dien-3-amine is sourced from PubChem (CID 156745371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).