(Z)-1-azidooctadec-9-ene

C18H35N3 — CID 51355200

IUPAC(Z)-1-azidooctadec-9-ene
SMILESCCCCCCCC/C=C\CCCCCCCCN=[N+]=[N-]
InChIInChI=1S/C18H35N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-21-19/h9-10H,2-8,11-18H2,1H3/b10-9-
InChIKeyGXVZKGGXCHNXOZ-KTKRTIGZSA-N
MW293.50 g/mol
LogP7.33
Rot. Bonds16

About (Z)-1-azidooctadec-9-ene

(Z)-1-azidooctadec-9-ene (PubChem CID 51355200) has the molecular formula C18H35N3 and a molecular weight of 293.50 g/mol. Its IUPAC name is (Z)-1-azidooctadec-9-ene.

Molecular Properties

Compound Name(Z)-1-azidooctadec-9-ene
PubChem CID51355200
Molecular FormulaC18H35N3
Molecular Weight293.50 g/mol
Exact Mass293.28
IUPAC Name(Z)-1-azidooctadec-9-ene
SMILESCCCCCCCC/C=C\CCCCCCCCN=[N+]=[N-]
InChIInChI=1S/C18H35N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-21-19/h9-10H,2-8,11-18H2,1H3/b10-9-
InChIKeyGXVZKGGXCHNXOZ-KTKRTIGZSA-N
XLogP7.33
TPSA48.76 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500293.50
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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(Z)-4-azidonon-2-ene
CID 134907628
(13z,17z)-1-Azidotri aconta-13,17-diene
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(Z)-1-azidododec-5-ene
CID 10656025
11-Azidotricos-1-ene
CID 19032292
(5Z,9Z)-3,12-di(undecyl)-1,2-diazacyclododeca-1,5,9-triene
CID 20332298
(5Z,9Z)-3,12-dibutyl-1,2-diazacyclododeca-1,5,9-triene
CID 20332301
(5Z,9Z)-3,12-di(nonyl)-1,2-diazacyclododeca-1,5,9-triene
CID 20559016
(5Z,9Z)-3,12-didecyl-1,2-diazacyclododeca-1,5,9-triene
CID 20559030

Frequently Asked Questions

What is the IUPAC name of (Z)-1-azidooctadec-9-ene?
The IUPAC name of (Z)-1-azidooctadec-9-ene (CID 51355200) is (Z)-1-azidooctadec-9-ene.
What is the SMILES notation for (Z)-1-azidooctadec-9-ene?
The canonical SMILES for (Z)-1-azidooctadec-9-ene is CCCCCCCC/C=C\CCCCCCCCN=[N+]=[N-].
What is the InChIKey of (Z)-1-azidooctadec-9-ene?
The InChIKey is GXVZKGGXCHNXOZ-KTKRTIGZSA-N. The full InChI is InChI=1S/C18H35N3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-21-19/h9-10H,2-8,11-18H2,1H3/b10-9-.
What are the key properties of (Z)-1-azidooctadec-9-ene?
(Z)-1-azidooctadec-9-ene has a molecular weight of 293.50 g/mol, XLogP of 7.33, 16 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-azidooctadec-9-ene is sourced from PubChem (CID 51355200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).