2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol

C10H15ClN2OS — CID 83153384

IUPAC2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CNc1nc(Cl)cs1
InChIInChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-5-7-3-1-2-4-8(7)14/h6-8,14H,1-5H2,(H,12,13)
InChIKeyBIRKOCAJDLVXIR-UHFFFAOYSA-N
MW246.76 g/mol
LogP2.76
Rot. Bonds3

About 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol

2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 83153384) has the molecular formula C10H15ClN2OS and a molecular weight of 246.76 g/mol. Its IUPAC name is 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
PubChem CID83153384
Molecular FormulaC10H15ClN2OS
Molecular Weight246.76 g/mol
Exact Mass246.06
IUPAC Name2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
SMILESOC1CCCCC1CNc1nc(Cl)cs1
InChIInChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-5-7-3-1-2-4-8(7)14/h6-8,14H,1-5H2,(H,12,13)
InChIKeyBIRKOCAJDLVXIR-UHFFFAOYSA-N
XLogP2.76
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.76
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(4-Methyl-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 64912098
2-[(1,3-Thiazol-2-ylamino)methyl]cyclohexan-1-ol
CID 64913544
2-[[(4-Bromo-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol
CID 79400140
[1-[(4-Chloro-1,3-thiazol-2-yl)amino]cyclohexyl]methanol
CID 83152184
4-[(4-Chloro-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
CID 83152279
[1-[(4-Chloro-1,3-thiazol-2-yl)amino]-4-methylcyclohexyl]methanol
CID 83152298
[1-[(4-Chloro-1,3-thiazol-2-yl)amino]-3-methylcyclohexyl]methanol
CID 83152299
3-[[(4-Chloro-1,3-thiazol-2-yl)amino]methyl]pentan-1-ol
CID 83152314
2-[[(4-Chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentan-1-ol
CID 83152428
[2-[[(4-Chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
CID 83152429
[2-[[(4-Chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexyl]methanol
CID 83152547
2-[(4-Chloro-1,3-thiazol-2-yl)amino]-4-methylpentan-1-ol
CID 83152646

Frequently Asked Questions

What is the IUPAC name of 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol (CID 83153384) is 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol is OC1CCCCC1CNc1nc(Cl)cs1.
What is the InChIKey of 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is BIRKOCAJDLVXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-5-7-3-1-2-4-8(7)14/h6-8,14H,1-5H2,(H,12,13).
What are the key properties of 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol?
2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 246.76 g/mol, XLogP of 2.76, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 83153384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).