[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol

C14H24N2OS — CID 112697676

IUPAC[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCc1nc(C)c(CNCC2(CO)CCCCC2)s1
InChIInChI=1S/C14H24N2OS/c1-11-13(18-12(2)16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3
InChIKeyXYYFDLNERWVBDX-UHFFFAOYSA-N
MW268.43 g/mol
LogP2.79
Rot. Bonds5

About [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol

[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol (PubChem CID 112697676) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol
PubChem CID112697676
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol
SMILESCc1nc(C)c(CNCC2(CO)CCCCC2)s1
InChIInChI=1S/C14H24N2OS/c1-11-13(18-12(2)16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3
InChIKeyXYYFDLNERWVBDX-UHFFFAOYSA-N
XLogP2.79
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol with MolForge

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Related Compounds

[1-[[(4,5-dimethyl-1,3-oxazol-2-yl)methylamino]methyl]cyclohexyl]methanol
CID 103966545
[1-[[(4-methyl-1,2,5-oxadiazol-3-yl)methylamino]methyl]cyclopentyl]methanol
CID 115359447
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-methylcyclobutan-1-amine
CID 115765694
1-amino-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]cyclohexane-1-carboxamide
CID 119891897
1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-[(1-hydroxycycloheptyl)methyl]urea
CID 111507929
[1-[[(4-methoxy-6-methyl-2-pyridinyl)methylamino]methyl]cyclohexyl]methanol
CID 115924168
[1-[[(1,3,5-trimethylpyrazol-4-yl)methylamino]methyl]cyclopentyl]methanol
CID 115358694
[1-[[(4-methoxy-6-methyl-2-pyridinyl)methylamino]methyl]cyclopentyl]methanol
CID 82893618
[1-[[(4-methylphenyl)methylamino]methyl]cyclopentyl]methanol
CID 113293545
[1-[[(2-methyl-1H-imidazol-5-yl)methylamino]methyl]cyclohexyl]methanol
CID 112697644
[1-[[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]methyl]cyclopentyl]methanol
CID 113293581
N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-1-(4-methylcyclohexyl)methanamine
CID 64540574

Frequently Asked Questions

What is the IUPAC name of [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol (CID 112697676) is [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol is Cc1nc(C)c(CNCC2(CO)CCCCC2)s1.
What is the InChIKey of [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol?
The InChIKey is XYYFDLNERWVBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-11-13(18-12(2)16-11)8-15-9-14(10-17)6-4-3-5-7-14/h15,17H,3-10H2,1-2H3.
What are the key properties of [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol?
[1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol has a molecular weight of 268.43 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(2,4-dimethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 112697676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).