N-cyclohexylnonan-1-imine

C15H29N — CID 10966137

IUPACN-cyclohexylnonan-1-imine
SMILESCCCCCCCC/C=N/C1CCCCC1
InChIInChI=1S/C15H29N/c1-2-3-4-5-6-7-11-14-16-15-12-9-8-10-13-15/h14-15H,2-13H2,1H3/b16-14+
InChIKeyZXYRSTIANCVWMI-JQIJEIRASA-N
MW223.40 g/mol
LogP5.14
Rot. Bonds8

About N-cyclohexylnonan-1-imine

N-cyclohexylnonan-1-imine (PubChem CID 10966137) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is N-cyclohexylnonan-1-imine.

Molecular Properties

Compound NameN-cyclohexylnonan-1-imine
PubChem CID10966137
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC NameN-cyclohexylnonan-1-imine
SMILESCCCCCCCC/C=N/C1CCCCC1
InChIInChI=1S/C15H29N/c1-2-3-4-5-6-7-11-14-16-15-12-9-8-10-13-15/h14-15H,2-13H2,1H3/b16-14+
InChIKeyZXYRSTIANCVWMI-JQIJEIRASA-N
XLogP5.14
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500223.40
LogP ≤ 55.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylnonan-1-imine?
The IUPAC name of N-cyclohexylnonan-1-imine (CID 10966137) is N-cyclohexylnonan-1-imine.
What is the SMILES notation for N-cyclohexylnonan-1-imine?
The canonical SMILES for N-cyclohexylnonan-1-imine is CCCCCCCC/C=N/C1CCCCC1.
What is the InChIKey of N-cyclohexylnonan-1-imine?
The InChIKey is ZXYRSTIANCVWMI-JQIJEIRASA-N. The full InChI is InChI=1S/C15H29N/c1-2-3-4-5-6-7-11-14-16-15-12-9-8-10-13-15/h14-15H,2-13H2,1H3/b16-14+.
What are the key properties of N-cyclohexylnonan-1-imine?
N-cyclohexylnonan-1-imine has a molecular weight of 223.40 g/mol, XLogP of 5.14, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylnonan-1-imine is sourced from PubChem (CID 10966137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).