1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine

C14H23N — CID 145149810

IUPAC1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine
SMILESC=C/N=C(\C=C(C)C)CC1CCCCC1
InChIInChI=1S/C14H23N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h4,10,13H,1,5-9,11H2,2-3H3/b15-14+
InChIKeyCWBLZMNAOXUTFB-CCEZHUSRSA-N
MW205.34 g/mol
LogP4.51
Rot. Bonds4

About 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine

1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine (PubChem CID 145149810) has the molecular formula C14H23N and a molecular weight of 205.34 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine.

Molecular Properties

Compound Name1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine
PubChem CID145149810
Molecular FormulaC14H23N
Molecular Weight205.34 g/mol
Exact Mass205.18
IUPAC Name1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine
SMILESC=C/N=C(\C=C(C)C)CC1CCCCC1
InChIInChI=1S/C14H23N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h4,10,13H,1,5-9,11H2,2-3H3/b15-14+
InChIKeyCWBLZMNAOXUTFB-CCEZHUSRSA-N
XLogP4.51
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.34
LogP ≤ 54.51
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 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine?
The IUPAC name of 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine (CID 145149810) is 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine.
What is the SMILES notation for 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine?
The canonical SMILES for 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine is C=C/N=C(\C=C(C)C)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine?
The InChIKey is CWBLZMNAOXUTFB-CCEZHUSRSA-N. The full InChI is InChI=1S/C14H23N/c1-4-15-14(10-12(2)3)11-13-8-6-5-7-9-13/h4,10,13H,1,5-9,11H2,2-3H3/b15-14+.
What are the key properties of 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine?
1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine has a molecular weight of 205.34 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethenyl-4-methylpent-3-en-2-imine is sourced from PubChem (CID 145149810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).