N,N-diethyltetradec-1-en-1-amine

C18H37N — CID 54402906

IUPACN,N-diethyltetradec-1-en-1-amine
SMILESCCCCCCCCCCCCC=CN(CC)CC
InChIInChI=1S/C18H37N/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19(5-2)6-3/h17-18H,4-16H2,1-3H3
InChIKeyVORSVTDTSCIZRA-UHFFFAOYSA-N
MW267.50 g/mol
LogP6.15
Rot. Bonds14

About N,N-diethyltetradec-1-en-1-amine

N,N-diethyltetradec-1-en-1-amine (PubChem CID 54402906) has the molecular formula C18H37N and a molecular weight of 267.50 g/mol. Its IUPAC name is N,N-diethyltetradec-1-en-1-amine.

Molecular Properties

Compound NameN,N-diethyltetradec-1-en-1-amine
PubChem CID54402906
Molecular FormulaC18H37N
Molecular Weight267.50 g/mol
Exact Mass267.29
IUPAC NameN,N-diethyltetradec-1-en-1-amine
SMILESCCCCCCCCCCCCC=CN(CC)CC
InChIInChI=1S/C18H37N/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19(5-2)6-3/h17-18H,4-16H2,1-3H3
InChIKeyVORSVTDTSCIZRA-UHFFFAOYSA-N
XLogP6.15
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.50
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-butyl-N-oct-1-enyloctan-1-amine
CID 139766519
(E)-N-ethyl-N-methyldec-1-en-1-amine
CID 14389662
N-hex-1-enyl-N-hexylhexan-1-amine
CID 54411369
N,N-dimethyloct-1-en-1-amine
CID 54004302
(E)-N,N-dimethylpentadec-1-en-1-amine
CID 22930940
N-methyl-N-oct-1-enyloct-1-en-1-amine
CID 74019016
N,N-dimethyltetradec-1-en-1-amine;propane
CID 173220262
(E)-hexacos-10-ene
CID 22172169
(Z)-docos-9-ene
CID 11690102
(E)-hexadec-6-ene
CID 5352260
(E)-nonacos-10-ene
CID 14367300
tetratriacont-8-ene
CID 123670593

Frequently Asked Questions

What is the IUPAC name of N,N-diethyltetradec-1-en-1-amine?
The IUPAC name of N,N-diethyltetradec-1-en-1-amine (CID 54402906) is N,N-diethyltetradec-1-en-1-amine.
What is the SMILES notation for N,N-diethyltetradec-1-en-1-amine?
The canonical SMILES for N,N-diethyltetradec-1-en-1-amine is CCCCCCCCCCCCC=CN(CC)CC.
What is the InChIKey of N,N-diethyltetradec-1-en-1-amine?
The InChIKey is VORSVTDTSCIZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37N/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19(5-2)6-3/h17-18H,4-16H2,1-3H3.
What are the key properties of N,N-diethyltetradec-1-en-1-amine?
N,N-diethyltetradec-1-en-1-amine has a molecular weight of 267.50 g/mol, XLogP of 6.15, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyltetradec-1-en-1-amine is sourced from PubChem (CID 54402906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).