N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine

C17H19NS — CID 123168690

IUPACN-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine
SMILESc1ccc(/C(=N/C2CCCCC2)c2ccsc2)cc1
InChIInChI=1S/C17H19NS/c1-3-7-14(8-4-1)17(15-11-12-19-13-15)18-16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2/b18-17-
InChIKeyUFABIZJRYHXMIL-ZCXUNETKSA-N
MW269.41 g/mol
LogP4.92
Rot. Bonds3

About N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine

N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine (PubChem CID 123168690) has the molecular formula C17H19NS and a molecular weight of 269.41 g/mol. Its IUPAC name is N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine.

Molecular Properties

Compound NameN-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine
PubChem CID123168690
Molecular FormulaC17H19NS
Molecular Weight269.41 g/mol
Exact Mass269.12
IUPAC NameN-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine
SMILESc1ccc(/C(=N/C2CCCCC2)c2ccsc2)cc1
InChIInChI=1S/C17H19NS/c1-3-7-14(8-4-1)17(15-11-12-19-13-15)18-16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2/b18-17-
InChIKeyUFABIZJRYHXMIL-ZCXUNETKSA-N
XLogP4.92
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.41
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

6-Phenyl-6,7-dihydro-thieno[3,2-c]pyridin-4-ylamine
CID 18785938
Ketone, phenyl 2-thienyl, oxime
CID 9570619
1-(2-Thienyl)ethanone (diphenylmethylene)hydrazone
CID 5722573
4-[4-(Trifluoromethyl)phenyl]-6,7-dihydrothieno[3,2-c]pyridine
CID 2739385
Benzenemethanamine, N-(2-thienylmethylene)-
CID 2740077
Phenyl-2-thienyldiazomethane
CID 12246538
1-phenyl-N-(thiophen-2-ylmethyl)methanimine
CID 13484482
1,1-diphenyl-N-(thiophen-2-ylmethyl)methanimine
CID 13484483
N-benzhydryl-1-thiophen-2-ylmethanimine
CID 13763460
(Z)-Phenyl(2-thienyl)methanone hydrazone
CID 5355671
4,5-diphenyl-2-thiophen-2-yl-4H-imidazole
CID 24870390
5-(4-fluorophenyl)-2-thiophen-2-yl-3,4-dihydro-2H-pyrrole
CID 18182759

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine?
The IUPAC name of N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine (CID 123168690) is N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine.
What is the SMILES notation for N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine?
The canonical SMILES for N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine is c1ccc(/C(=N/C2CCCCC2)c2ccsc2)cc1.
What is the InChIKey of N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine?
The InChIKey is UFABIZJRYHXMIL-ZCXUNETKSA-N. The full InChI is InChI=1S/C17H19NS/c1-3-7-14(8-4-1)17(15-11-12-19-13-15)18-16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2/b18-17-.
What are the key properties of N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine?
N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine has a molecular weight of 269.41 g/mol, XLogP of 4.92, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-phenyl-1-thiophen-3-ylmethanimine is sourced from PubChem (CID 123168690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).