N-cyclohexyl-1-(cyclopenten-1-yl)methanimine

C12H19N — CID 14472917

IUPACN-cyclohexyl-1-(cyclopenten-1-yl)methanimine
SMILESC1=C(/C=N/C2CCCCC2)CCC1
InChIInChI=1S/C12H19N/c1-2-8-12(9-3-1)13-10-11-6-4-5-7-11/h6,10,12H,1-5,7-9H2/b13-10+
InChIKeyVDKKZSFGLPSGRK-JLHYYAGUSA-N
MW177.29 g/mol
LogP3.50
Rot. Bonds2

About N-cyclohexyl-1-(cyclopenten-1-yl)methanimine

N-cyclohexyl-1-(cyclopenten-1-yl)methanimine (PubChem CID 14472917) has the molecular formula C12H19N and a molecular weight of 177.29 g/mol. Its IUPAC name is N-cyclohexyl-1-(cyclopenten-1-yl)methanimine.

Molecular Properties

Compound NameN-cyclohexyl-1-(cyclopenten-1-yl)methanimine
PubChem CID14472917
Molecular FormulaC12H19N
Molecular Weight177.29 g/mol
Exact Mass177.15
IUPAC NameN-cyclohexyl-1-(cyclopenten-1-yl)methanimine
SMILESC1=C(/C=N/C2CCCCC2)CCC1
InChIInChI=1S/C12H19N/c1-2-8-12(9-3-1)13-10-11-6-4-5-7-11/h6,10,12H,1-5,7-9H2/b13-10+
InChIKeyVDKKZSFGLPSGRK-JLHYYAGUSA-N
XLogP3.50
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.29
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Azabicyclo[2.2.1]hepta-2,4-diene
CID 53648942
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(E)-N-cyclohexyl-2-ethylbut-2-en-1-imine
CID 127262357
copper(1+);N-cyclohexyl-1-phenylmethanimine
CID 135046006
N-cyclohexyl-6-methylhept-5-en-2-imine
CID 11009116
N-cyclohexyl-1-cyclopenta-1,3-dien-1-ylmethanimine
CID 18293350
(E)-N-cyclohexyl-2-ethylhept-2-en-1-imine
CID 23394363
N-cyclohexyl-2-ethylhept-2-en-1-imine
CID 74047303
N-cyclohexyl-3,7-dimethylocta-2,6-dien-1-imine
CID 85299666
4-Ethyl-2-methyl-2,3-dihydropyridine
CID 89150349
5-Propan-2-yl-2-propyl-2,3-dihydropyridine
CID 89592567
5-Methyl-2-propyl-2,3-dihydropyridine
CID 89595246

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(cyclopenten-1-yl)methanimine?
The IUPAC name of N-cyclohexyl-1-(cyclopenten-1-yl)methanimine (CID 14472917) is N-cyclohexyl-1-(cyclopenten-1-yl)methanimine.
What is the SMILES notation for N-cyclohexyl-1-(cyclopenten-1-yl)methanimine?
The canonical SMILES for N-cyclohexyl-1-(cyclopenten-1-yl)methanimine is C1=C(/C=N/C2CCCCC2)CCC1.
What is the InChIKey of N-cyclohexyl-1-(cyclopenten-1-yl)methanimine?
The InChIKey is VDKKZSFGLPSGRK-JLHYYAGUSA-N. The full InChI is InChI=1S/C12H19N/c1-2-8-12(9-3-1)13-10-11-6-4-5-7-11/h6,10,12H,1-5,7-9H2/b13-10+.
What are the key properties of N-cyclohexyl-1-(cyclopenten-1-yl)methanimine?
N-cyclohexyl-1-(cyclopenten-1-yl)methanimine has a molecular weight of 177.29 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(cyclopenten-1-yl)methanimine is sourced from PubChem (CID 14472917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).