(E)-N,N-dimethylpentadec-1-en-1-amine

C17H35N — CID 22930940

IUPAC(E)-N,N-dimethylpentadec-1-en-1-amine
SMILESCCCCCCCCCCCCC/C=C/N(C)C
InChIInChI=1S/C17H35N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)3/h16-17H,4-15H2,1-3H3/b17-16+
InChIKeyFCOFJFUCVRLXCM-WUKNDPDISA-N
MW253.47 g/mol
LogP5.76
Rot. Bonds13

About (E)-N,N-dimethylpentadec-1-en-1-amine

(E)-N,N-dimethylpentadec-1-en-1-amine (PubChem CID 22930940) has the molecular formula C17H35N and a molecular weight of 253.47 g/mol. Its IUPAC name is (E)-N,N-dimethylpentadec-1-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-dimethylpentadec-1-en-1-amine
PubChem CID22930940
Molecular FormulaC17H35N
Molecular Weight253.47 g/mol
Exact Mass253.28
IUPAC Name(E)-N,N-dimethylpentadec-1-en-1-amine
SMILESCCCCCCCCCCCCC/C=C/N(C)C
InChIInChI=1S/C17H35N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)3/h16-17H,4-15H2,1-3H3/b17-16+
InChIKeyFCOFJFUCVRLXCM-WUKNDPDISA-N
XLogP5.76
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500253.47
LogP ≤ 55.76
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,N-dimethyloct-1-en-1-amine
CID 54004302
N,N-dimethyltetradec-1-en-1-amine;propane
CID 173220262
(1E,7E)-N,N,N',N'-tetramethylocta-1,7-diene-1,8-diamine
CID 141423827
N-methyl-N-oct-1-enyloct-1-en-1-amine
CID 74019016
(E)-N-ethyl-N-methyldec-1-en-1-amine
CID 14389662
N,N-diethyltetradec-1-en-1-amine
CID 54402906
(24Z)-hexatriaconta-9,24-diene
CID 173127472
(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 (E)-N,N-dimethylpentadec-1-en-1-amine?
The IUPAC name of (E)-N,N-dimethylpentadec-1-en-1-amine (CID 22930940) is (E)-N,N-dimethylpentadec-1-en-1-amine.
What is the SMILES notation for (E)-N,N-dimethylpentadec-1-en-1-amine?
The canonical SMILES for (E)-N,N-dimethylpentadec-1-en-1-amine is CCCCCCCCCCCCC/C=C/N(C)C.
What is the InChIKey of (E)-N,N-dimethylpentadec-1-en-1-amine?
The InChIKey is FCOFJFUCVRLXCM-WUKNDPDISA-N. The full InChI is InChI=1S/C17H35N/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(2)3/h16-17H,4-15H2,1-3H3/b17-16+.
What are the key properties of (E)-N,N-dimethylpentadec-1-en-1-amine?
(E)-N,N-dimethylpentadec-1-en-1-amine has a molecular weight of 253.47 g/mol, XLogP of 5.76, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dimethylpentadec-1-en-1-amine is sourced from PubChem (CID 22930940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).