(Z)-N-propyltridec-4-en-1-amine

C16H33N — CID 174276526

IUPAC(Z)-N-propyltridec-4-en-1-amine
SMILESCCCCCCCC/C=C\CCCNCCC
InChIInChI=1S/C16H33N/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2/h11-12,17H,3-10,13-16H2,1-2H3/b12-11-
InChIKeyUKOIROXKOQUINT-QXMHVHEDSA-N
MW239.45 g/mol
LogP5.07
Rot. Bonds13

About (Z)-N-propyltridec-4-en-1-amine

(Z)-N-propyltridec-4-en-1-amine (PubChem CID 174276526) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is (Z)-N-propyltridec-4-en-1-amine.

Molecular Properties

Compound Name(Z)-N-propyltridec-4-en-1-amine
PubChem CID174276526
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC Name(Z)-N-propyltridec-4-en-1-amine
SMILESCCCCCCCC/C=C\CCCNCCC
InChIInChI=1S/C16H33N/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2/h11-12,17H,3-10,13-16H2,1-2H3/b12-11-
InChIKeyUKOIROXKOQUINT-QXMHVHEDSA-N
XLogP5.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500239.45
LogP ≤ 55.07
H-Bond Donors ≤ 51
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

(Z)-N-hexadecyloctadec-9-en-1-amine
CID 86624385
(Z)-N-[(Z)-octadec-9-enyl]henicos-12-en-1-amine
CID 146653047
(E)-N-[(E)-heptadec-8-enyl]heptadec-8-en-1-amine
CID 162361236
(12Z,15Z)-N-[(11Z,14Z)-icosa-11,14-dienyl]henicosa-12,15-dien-1-amine
CID 129018541
(Z)-N-propylhept-4-en-1-amine
CID 142957499
N'-[(E)-octadec-9-enyl]propane-1,3-diamine
CID 6365166
N'-[2-[2-[2-[2-[2-(octadec-9-enylamino)ethylamino]ethylamino]ethylamino]ethylamino]ethyl]ethane-1,2-diamine
CID 154268370
N-octadec-17-enyloctadec-9-en-1-amine
CID 123898051
[[(Z)-octadec-9-enyl]amino]methanol
CID 143220768
N-propylhexadecan-1-amine
CID 18792182
(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102

Frequently Asked Questions

What is the IUPAC name of (Z)-N-propyltridec-4-en-1-amine?
The IUPAC name of (Z)-N-propyltridec-4-en-1-amine (CID 174276526) is (Z)-N-propyltridec-4-en-1-amine.
What is the SMILES notation for (Z)-N-propyltridec-4-en-1-amine?
The canonical SMILES for (Z)-N-propyltridec-4-en-1-amine is CCCCCCCC/C=C\CCCNCCC.
What is the InChIKey of (Z)-N-propyltridec-4-en-1-amine?
The InChIKey is UKOIROXKOQUINT-QXMHVHEDSA-N. The full InChI is InChI=1S/C16H33N/c1-3-5-6-7-8-9-10-11-12-13-14-16-17-15-4-2/h11-12,17H,3-10,13-16H2,1-2H3/b12-11-.
What are the key properties of (Z)-N-propyltridec-4-en-1-amine?
(Z)-N-propyltridec-4-en-1-amine has a molecular weight of 239.45 g/mol, XLogP of 5.07, 13 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-propyltridec-4-en-1-amine is sourced from PubChem (CID 174276526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).