N,N-dimethylocta-3,5,7-trien-2-amine

C10H17N — CID 150933257

IUPACN,N-dimethylocta-3,5,7-trien-2-amine
SMILESC=CC=CC=CC(C)N(C)C
InChIInChI=1S/C10H17N/c1-5-6-7-8-9-10(2)11(3)4/h5-10H,1H2,2-4H3
InChIKeyLGLZKHKKYDEABC-UHFFFAOYSA-N
MW151.25 g/mol
LogP2.23
Rot. Bonds4

About N,N-dimethylocta-3,5,7-trien-2-amine

N,N-dimethylocta-3,5,7-trien-2-amine (PubChem CID 150933257) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is N,N-dimethylocta-3,5,7-trien-2-amine.

Molecular Properties

Compound NameN,N-dimethylocta-3,5,7-trien-2-amine
PubChem CID150933257
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC NameN,N-dimethylocta-3,5,7-trien-2-amine
SMILESC=CC=CC=CC(C)N(C)C
InChIInChI=1S/C10H17N/c1-5-6-7-8-9-10(2)11(3)4/h5-10H,1H2,2-4H3
InChIKeyLGLZKHKKYDEABC-UHFFFAOYSA-N
XLogP2.23
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.23
H-Bond Donors ≤ 50
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 5744778
1-Methyl-2-vinylpyridine
CID 19781255
N-methyl-2,6-lutidine
CID 68311864
1,2-Dimethyl-5-vinyl pyridine
CID 69342103
N,N-dimethyl-4-methylidenecyclohexa-2,5-dien-1-amine
CID 89204023
2-Methyl-2-aza-5,7-octadiene
CID 123595184
3-Octen-2-amine, N,N-dimethyl-, (E)-
CID 5372576
(3E,5Z)-7-(fluoromethyl)-N,3-dimethyl-N-propylocta-3,5,7-trien-2-amine
CID 146586092
N,N-Diethyl-trans-2-penteneamine
CID 5365212
2-Penten-1-amine, N,N-diethyl-, (Z)-
CID 5365213
2-Methyl-1-propan-2-yl-2,5-dihydropyrrole
CID 25198141
N,N-di(cyclohepta-2,4,6-trien-1-yl)cyclohepta-2,4,6-trien-1-amine
CID 85537147

Frequently Asked Questions

What is the IUPAC name of N,N-dimethylocta-3,5,7-trien-2-amine?
The IUPAC name of N,N-dimethylocta-3,5,7-trien-2-amine (CID 150933257) is N,N-dimethylocta-3,5,7-trien-2-amine.
What is the SMILES notation for N,N-dimethylocta-3,5,7-trien-2-amine?
The canonical SMILES for N,N-dimethylocta-3,5,7-trien-2-amine is C=CC=CC=CC(C)N(C)C.
What is the InChIKey of N,N-dimethylocta-3,5,7-trien-2-amine?
The InChIKey is LGLZKHKKYDEABC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N/c1-5-6-7-8-9-10(2)11(3)4/h5-10H,1H2,2-4H3.
What are the key properties of N,N-dimethylocta-3,5,7-trien-2-amine?
N,N-dimethylocta-3,5,7-trien-2-amine has a molecular weight of 151.25 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylocta-3,5,7-trien-2-amine is sourced from PubChem (CID 150933257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).