1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine

C15H18N2S — CID 61338251

IUPAC1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine
SMILESNC1(c2nc(-c3ccccc3)cs2)CCCCC1
InChIInChI=1S/C15H18N2S/c16-15(9-5-2-6-10-15)14-17-13(11-18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,16H2
InChIKeyINPXRMDSOLJOJE-UHFFFAOYSA-N
MW258.39 g/mol
LogP3.93
Rot. Bonds2

About 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine

1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine (PubChem CID 61338251) has the molecular formula C15H18N2S and a molecular weight of 258.39 g/mol. Its IUPAC name is 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine
PubChem CID61338251
Molecular FormulaC15H18N2S
Molecular Weight258.39 g/mol
Exact Mass258.12
IUPAC Name1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine
SMILESNC1(c2nc(-c3ccccc3)cs2)CCCCC1
InChIInChI=1S/C15H18N2S/c16-15(9-5-2-6-10-15)14-17-13(11-18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,16H2
InChIKeyINPXRMDSOLJOJE-UHFFFAOYSA-N
XLogP3.93
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.39
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]cyclopropan-1-amine
CID 134081875
1-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]cyclohexan-1-amine
CID 61338059
3-methyl-1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine
CID 61338469
1-[4-(3-chlorophenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine;hydrochloride
CID 120558286
1-[4-(4-propan-2-ylphenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine
CID 61336894
1-(4-pyridin-2-yl-1,3-thiazol-2-yl)cyclopentan-1-amine
CID 61337663
1-[4-[4-(difluoromethoxy)phenyl]-1,3-thiazol-2-yl]cyclopentan-1-amine;hydrochloride
CID 120558257
1-[4-(4-methylsulfonylphenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine
CID 61336316
1-[4-(4-propan-2-yloxyphenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine
CID 61338048
1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclopentan-1-amine;hydrochloride
CID 120558260
1-[4-(5-methylthiophen-2-yl)-1,3-thiazol-2-yl]cycloheptan-1-amine
CID 61338658
1-[4-(5-bromothiophen-2-yl)-1,3-thiazol-2-yl]cycloheptan-1-amine
CID 61338856

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The IUPAC name of 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine (CID 61338251) is 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine.
What is the SMILES notation for 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The canonical SMILES for 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine is NC1(c2nc(-c3ccccc3)cs2)CCCCC1.
What is the InChIKey of 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
The InChIKey is INPXRMDSOLJOJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2S/c16-15(9-5-2-6-10-15)14-17-13(11-18-14)12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10,16H2.
What are the key properties of 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine?
1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine has a molecular weight of 258.39 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenyl-1,3-thiazol-2-yl)cyclohexan-1-amine is sourced from PubChem (CID 61338251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).