N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine

C15H27N — CID 130242925

IUPACN,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine
SMILESC=C(C)C(C(=C)C)=C(C)C(C)CCCNC
InChIInChI=1S/C15H27N/c1-11(2)15(12(3)4)14(6)13(5)9-8-10-16-7/h13,16H,1,3,8-10H2,2,4-7H3
InChIKeyGJGSTOXGYOHNSA-UHFFFAOYSA-N
MW221.39 g/mol
LogP4.09
Rot. Bonds7

About N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine

N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine (PubChem CID 130242925) has the molecular formula C15H27N and a molecular weight of 221.39 g/mol. Its IUPAC name is N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine.

Molecular Properties

Compound NameN,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine
PubChem CID130242925
Molecular FormulaC15H27N
Molecular Weight221.39 g/mol
Exact Mass221.21
IUPAC NameN,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine
SMILESC=C(C)C(C(=C)C)=C(C)C(C)CCCNC
InChIInChI=1S/C15H27N/c1-11(2)15(12(3)4)14(6)13(5)9-8-10-16-7/h13,16H,1,3,8-10H2,2,4-7H3
InChIKeyGJGSTOXGYOHNSA-UHFFFAOYSA-N
XLogP4.09
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.39
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,7-Dimethyloct-6-en-1-amine
CID 3016807
N-methyl-1-(2,4,6-trimethylcyclohex-3-en-1-yl)methanamine
CID 2855350
(3,7-Dimethyloct-6-en-1-yl)(methyl)amine
CID 22251448
[(2,6-Dimethylcyclohex-2-en-1-yl)methyl](methyl)amine
CID 130645649
(2,6-Dimethylhept-5-en-1-yl)(methyl)amine
CID 146817482
{[(1R)-cyclohex-3-en-1-yl]methyl}(methyl)amine hydrochloride
CID 177798572
[(2,4-Dimethylcyclohex-3-en-1-yl)methyl](methyl)amine
CID 177798578
{[(1S)-cyclohex-3-en-1-yl]methyl}(methyl)amine hydrochloride
CID 177798581
4-ethyl-2-(1-fluoro-2-methylprop-2-enyl)-N-methylhept-4-en-1-amine
CID 123263201
7-(fluoromethyl)-N,2,8-trimethylnon-6-en-1-amine
CID 123264703
7-fluoro-N,3-dimethyl-4-methylideneocta-5,7-dien-1-amine
CID 123382807
(Z)-4-[(Z)-3-fluoroprop-1-enyl]-N,3-dimethylhept-4-en-1-amine
CID 129210432

Frequently Asked Questions

What is the IUPAC name of N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine?
The IUPAC name of N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine (CID 130242925) is N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine.
What is the SMILES notation for N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine?
The canonical SMILES for N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine is C=C(C)C(C(=C)C)=C(C)C(C)CCCNC.
What is the InChIKey of N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine?
The InChIKey is GJGSTOXGYOHNSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N/c1-11(2)15(12(3)4)14(6)13(5)9-8-10-16-7/h13,16H,1,3,8-10H2,2,4-7H3.
What are the key properties of N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine?
N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine has a molecular weight of 221.39 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4,5,7-tetramethyl-6-prop-1-en-2-ylocta-5,7-dien-1-amine is sourced from PubChem (CID 130242925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).