(Z)-N-phosphanyloctadec-9-en-1-amine

C18H38NP — CID 175310828

IUPAC(Z)-N-phosphanyloctadec-9-en-1-amine
SMILESCCCCCCCC/C=C\CCCCCCCCNP
InChIInChI=1S/C18H38NP/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h9-10,19H,2-8,11-18,20H2,1H3/b10-9-
InChIKeyXNEXBIMCNXWBRA-KTKRTIGZSA-N
MW299.48 g/mol
LogP6.40
Rot. Bonds16

About (Z)-N-phosphanyloctadec-9-en-1-amine

(Z)-N-phosphanyloctadec-9-en-1-amine (PubChem CID 175310828) has the molecular formula C18H38NP and a molecular weight of 299.48 g/mol. Its IUPAC name is (Z)-N-phosphanyloctadec-9-en-1-amine.

Molecular Properties

Compound Name(Z)-N-phosphanyloctadec-9-en-1-amine
PubChem CID175310828
Molecular FormulaC18H38NP
Molecular Weight299.48 g/mol
Exact Mass299.27
IUPAC Name(Z)-N-phosphanyloctadec-9-en-1-amine
SMILESCCCCCCCC/C=C\CCCCCCCCNP
InChIInChI=1S/C18H38NP/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h9-10,19H,2-8,11-18,20H2,1H3/b10-9-
InChIKeyXNEXBIMCNXWBRA-KTKRTIGZSA-N
XLogP6.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500299.48
LogP ≤ 56.40
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'}, {'alert_name': 'phosphor', '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
(Z)-tricos-11-ene
CID 5356790
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
(24Z)-hexatriaconta-9,24-diene
CID 173127472
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020

Frequently Asked Questions

What is the IUPAC name of (Z)-N-phosphanyloctadec-9-en-1-amine?
The IUPAC name of (Z)-N-phosphanyloctadec-9-en-1-amine (CID 175310828) is (Z)-N-phosphanyloctadec-9-en-1-amine.
What is the SMILES notation for (Z)-N-phosphanyloctadec-9-en-1-amine?
The canonical SMILES for (Z)-N-phosphanyloctadec-9-en-1-amine is CCCCCCCC/C=C\CCCCCCCCNP.
What is the InChIKey of (Z)-N-phosphanyloctadec-9-en-1-amine?
The InChIKey is XNEXBIMCNXWBRA-KTKRTIGZSA-N. The full InChI is InChI=1S/C18H38NP/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20/h9-10,19H,2-8,11-18,20H2,1H3/b10-9-.
What are the key properties of (Z)-N-phosphanyloctadec-9-en-1-amine?
(Z)-N-phosphanyloctadec-9-en-1-amine has a molecular weight of 299.48 g/mol, XLogP of 6.40, 16 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-phosphanyloctadec-9-en-1-amine is sourced from PubChem (CID 175310828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).