N,N,4-trimethylpentadec-1-en-6-amine

C18H37N — CID 170848016

IUPACN,N,4-trimethylpentadec-1-en-6-amine
SMILESC=CCC(C)CC(CCCCCCCCC)N(C)C
InChIInChI=1S/C18H37N/c1-6-8-9-10-11-12-13-15-18(19(4)5)16-17(3)14-7-2/h7,17-18H,2,6,8-16H2,1,3-5H3
InChIKeyJZAKKIKPXUTOJU-UHFFFAOYSA-N
MW267.50 g/mol
LogP5.66
Rot. Bonds13

About N,N,4-trimethylpentadec-1-en-6-amine

N,N,4-trimethylpentadec-1-en-6-amine (PubChem CID 170848016) has the molecular formula C18H37N and a molecular weight of 267.50 g/mol. Its IUPAC name is N,N,4-trimethylpentadec-1-en-6-amine.

Molecular Properties

Compound NameN,N,4-trimethylpentadec-1-en-6-amine
PubChem CID170848016
Molecular FormulaC18H37N
Molecular Weight267.50 g/mol
Exact Mass267.29
IUPAC NameN,N,4-trimethylpentadec-1-en-6-amine
SMILESC=CCC(C)CC(CCCCCCCCC)N(C)C
InChIInChI=1S/C18H37N/c1-6-8-9-10-11-12-13-15-18(19(4)5)16-17(3)14-7-2/h7,17-18H,2,6,8-16H2,1,3-5H3
InChIKeyJZAKKIKPXUTOJU-UHFFFAOYSA-N
XLogP5.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.50
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Dioleylpropyl trimethylammonium chloride
CID 129829602
1,2-dilinoleyl-N,N-dimethyl-3-aminopropane
CID 139600217
N-(6-fluorooctan-4-yl)-N-methyl-11-methylidene-7-propyltridec-12-en-6-amine
CID 170075652
2,3-Dihydro-2-azasqualene
CID 129725423
N,N,2,5-tetraethylhept-6-en-1-amine
CID 170847767
N,N-dimethylpentadec-1-en-6-amine
CID 170848015
N,N-dimethyltetradec-1-en-5-amine
CID 170848019
N,N-dimethyl-6-propylundec-7-en-4-amine
CID 170848026
N,N-dimethyl-6-propylundec-8-en-4-amine
CID 170848027
N,N-dimethyl-8-pentylpentadec-9-en-6-amine
CID 170848028
N,N-dimethyl-8-pentylpentadec-10-en-6-amine
CID 170848029
N,N-diethyl-6-methylnon-8-en-1-amine
CID 170848095

Frequently Asked Questions

What is the IUPAC name of N,N,4-trimethylpentadec-1-en-6-amine?
The IUPAC name of N,N,4-trimethylpentadec-1-en-6-amine (CID 170848016) is N,N,4-trimethylpentadec-1-en-6-amine.
What is the SMILES notation for N,N,4-trimethylpentadec-1-en-6-amine?
The canonical SMILES for N,N,4-trimethylpentadec-1-en-6-amine is C=CCC(C)CC(CCCCCCCCC)N(C)C.
What is the InChIKey of N,N,4-trimethylpentadec-1-en-6-amine?
The InChIKey is JZAKKIKPXUTOJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N/c1-6-8-9-10-11-12-13-15-18(19(4)5)16-17(3)14-7-2/h7,17-18H,2,6,8-16H2,1,3-5H3.
What are the key properties of N,N,4-trimethylpentadec-1-en-6-amine?
N,N,4-trimethylpentadec-1-en-6-amine has a molecular weight of 267.50 g/mol, XLogP of 5.66, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,4-trimethylpentadec-1-en-6-amine is sourced from PubChem (CID 170848016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).