N-cyclohexylpent-3-en-2-imine

C11H19N — CID 174297228

IUPACN-cyclohexylpent-3-en-2-imine
SMILESCC=C/C(C)=N/C1CCCCC1
InChIInChI=1S/C11H19N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h3,7,11H,4-6,8-9H2,1-2H3/b7-3?,12-10+
InChIKeyBTLBOHBXSHHKFN-BXXCPVCWSA-N
MW165.28 g/mol
LogP3.36
Rot. Bonds2

About N-cyclohexylpent-3-en-2-imine

N-cyclohexylpent-3-en-2-imine (PubChem CID 174297228) has the molecular formula C11H19N and a molecular weight of 165.28 g/mol. Its IUPAC name is N-cyclohexylpent-3-en-2-imine.

Molecular Properties

Compound NameN-cyclohexylpent-3-en-2-imine
PubChem CID174297228
Molecular FormulaC11H19N
Molecular Weight165.28 g/mol
Exact Mass165.15
IUPAC NameN-cyclohexylpent-3-en-2-imine
SMILESCC=C/C(C)=N/C1CCCCC1
InChIInChI=1S/C11H19N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h3,7,11H,4-6,8-9H2,1-2H3/b7-3?,12-10+
InChIKeyBTLBOHBXSHHKFN-BXXCPVCWSA-N
XLogP3.36
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.28
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexylpent-3-en-2-imine?
The IUPAC name of N-cyclohexylpent-3-en-2-imine (CID 174297228) is N-cyclohexylpent-3-en-2-imine.
What is the SMILES notation for N-cyclohexylpent-3-en-2-imine?
The canonical SMILES for N-cyclohexylpent-3-en-2-imine is CC=C/C(C)=N/C1CCCCC1.
What is the InChIKey of N-cyclohexylpent-3-en-2-imine?
The InChIKey is BTLBOHBXSHHKFN-BXXCPVCWSA-N. The full InChI is InChI=1S/C11H19N/c1-3-7-10(2)12-11-8-5-4-6-9-11/h3,7,11H,4-6,8-9H2,1-2H3/b7-3?,12-10+.
What are the key properties of N-cyclohexylpent-3-en-2-imine?
N-cyclohexylpent-3-en-2-imine has a molecular weight of 165.28 g/mol, XLogP of 3.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexylpent-3-en-2-imine is sourced from PubChem (CID 174297228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).