N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine

C17H30N2 — CID 23578229

IUPACN-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine
SMILESC/C(=C/C(C)=N/C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C17H30N2/c1-14(18-16-9-5-3-6-10-16)13-15(2)19-17-11-7-4-8-12-17/h13,16-18H,3-12H2,1-2H3/b14-13-,19-15+
InChIKeyXKARPJLZOZHNMC-GCYSJDCNSA-N
MW262.44 g/mol
LogP4.61
Rot. Bonds4

About N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine

N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine (PubChem CID 23578229) has the molecular formula C17H30N2 and a molecular weight of 262.44 g/mol. Its IUPAC name is N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine.

Molecular Properties

Compound NameN-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine
PubChem CID23578229
Molecular FormulaC17H30N2
Molecular Weight262.44 g/mol
Exact Mass262.24
IUPAC NameN-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine
SMILESC/C(=C/C(C)=N/C1CCCCC1)NC1CCCCC1
InChIInChI=1S/C17H30N2/c1-14(18-16-9-5-3-6-10-16)13-15(2)19-17-11-7-4-8-12-17/h13,16-18H,3-12H2,1-2H3/b14-13-,19-15+
InChIKeyXKARPJLZOZHNMC-GCYSJDCNSA-N
XLogP4.61
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.44
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine?
The IUPAC name of N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine (CID 23578229) is N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine.
What is the SMILES notation for N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine?
The canonical SMILES for N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine is C/C(=C/C(C)=N/C1CCCCC1)NC1CCCCC1.
What is the InChIKey of N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine?
The InChIKey is XKARPJLZOZHNMC-GCYSJDCNSA-N. The full InChI is InChI=1S/C17H30N2/c1-14(18-16-9-5-3-6-10-16)13-15(2)19-17-11-7-4-8-12-17/h13,16-18H,3-12H2,1-2H3/b14-13-,19-15+.
What are the key properties of N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine?
N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine has a molecular weight of 262.44 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine is sourced from PubChem (CID 23578229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).