1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine

C19H24N2S — CID 144959114

IUPAC1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine
SMILESC=C(NCCc1csc(-c2ccccc2)n1)C1CCCCC1
InChIInChI=1S/C19H24N2S/c1-15(16-8-4-2-5-9-16)20-13-12-18-14-22-19(21-18)17-10-6-3-7-11-17/h3,6-7,10-11,14,16,20H,1-2,4-5,8-9,12-13H2
InChIKeyOPJCJLXDSVXDMQ-UHFFFAOYSA-N
MW312.48 g/mol
LogP5.04
Rot. Bonds6

About 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine

1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine (PubChem CID 144959114) has the molecular formula C19H24N2S and a molecular weight of 312.48 g/mol. Its IUPAC name is 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine.

Molecular Properties

Compound Name1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine
PubChem CID144959114
Molecular FormulaC19H24N2S
Molecular Weight312.48 g/mol
Exact Mass312.17
IUPAC Name1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine
SMILESC=C(NCCc1csc(-c2ccccc2)n1)C1CCCCC1
InChIInChI=1S/C19H24N2S/c1-15(16-8-4-2-5-9-16)20-13-12-18-14-22-19(21-18)17-10-6-3-7-11-17/h3,6-7,10-11,14,16,20H,1-2,4-5,8-9,12-13H2
InChIKeyOPJCJLXDSVXDMQ-UHFFFAOYSA-N
XLogP5.04
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.48
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopropyl-3-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]urea
CID 51710217
N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]piperidine-4-carboxamide
CID 119266960
2-(cyclobutylmethyl)-1-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]guanidine
CID 111975709
4-[2-(2-phenyl-1,3-thiazol-4-yl)ethylcarbamoylamino]cyclohexane-1-carboxylic acid
CID 122005819
9-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]bicyclo[3.3.1]nonane-3-carboxamide
CID 120992137
9-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]bicyclo[3.3.1]nonane-3-carboxamide;hydrochloride
CID 120992136
1,2-dimethyl-3-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]guanidine
CID 111975145
2-methyl-1-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]guanidine
CID 111975161
4-amino-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 119266976
1-(3-methylfuran-2-yl)-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine
CID 144959140
1,2-dimethyl-3-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]guanidine;hydroiodide
CID 111975144
2-hydroxy-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]benzamide
CID 162665630

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine?
The IUPAC name of 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine (CID 144959114) is 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine.
What is the SMILES notation for 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine?
The canonical SMILES for 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine is C=C(NCCc1csc(-c2ccccc2)n1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine?
The InChIKey is OPJCJLXDSVXDMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2S/c1-15(16-8-4-2-5-9-16)20-13-12-18-14-22-19(21-18)17-10-6-3-7-11-17/h3,6-7,10-11,14,16,20H,1-2,4-5,8-9,12-13H2.
What are the key properties of 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine?
1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine has a molecular weight of 312.48 g/mol, XLogP of 5.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[2-(2-phenyl-1,3-thiazol-4-yl)ethyl]ethenamine is sourced from PubChem (CID 144959114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).