2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol

C10H15ClN2OS — CID 104879247

IUPAC2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CNCc1ncc(Cl)s1
InChIInChI=1S/C10H15ClN2OS/c11-9-5-13-10(15-9)6-12-4-7-2-1-3-8(7)14/h5,7-8,12,14H,1-4,6H2
InChIKeyILXMKFQPRWERHN-UHFFFAOYSA-N
MW246.76 g/mol
LogP2.05
Rot. Bonds4

About 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol

2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 104879247) has the molecular formula C10H15ClN2OS and a molecular weight of 246.76 g/mol. Its IUPAC name is 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol
PubChem CID104879247
Molecular FormulaC10H15ClN2OS
Molecular Weight246.76 g/mol
Exact Mass246.06
IUPAC Name2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol
SMILESOC1CCCC1CNCc1ncc(Cl)s1
InChIInChI=1S/C10H15ClN2OS/c11-9-5-13-10(15-9)6-12-4-7-2-1-3-8(7)14/h5,7-8,12,14H,1-4,6H2
InChIKeyILXMKFQPRWERHN-UHFFFAOYSA-N
XLogP2.05
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.76
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 104879210
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-1-(thian-4-yl)methanamine
CID 104879104
2-[[(2-ethyl-1,3-thiazol-5-yl)methylamino]methyl]cyclohexan-1-ol
CID 64927098
2-[[(2-chloro-3-pyridinyl)methylamino]methyl]cyclopentan-1-ol
CID 115656377
2-[[(2,3,6-trichlorophenyl)methylamino]methyl]cyclopentan-1-ol
CID 79025608
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-2-ethylcyclohexan-1-amine
CID 104878566
2-[[(4-bromo-5-chlorothiophen-2-yl)methylamino]methyl]cyclohexan-1-ol
CID 102836063
2-[[(3,5-dibromo-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
CID 113393731
N-[(5-chloro-1,3-thiazol-2-yl)methyl]prop-2-yn-1-amine
CID 104878439
2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]-2-ethylbutan-1-ol
CID 104879510
1-(5-chloro-1,3-thiazol-2-yl)-N-[(1-methylcyclohexyl)methyl]methanamine
CID 104879340
2-[1-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopropyl]ethanol
CID 104954546

Frequently Asked Questions

What is the IUPAC name of 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol (CID 104879247) is 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol is OC1CCCC1CNCc1ncc(Cl)s1.
What is the InChIKey of 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is ILXMKFQPRWERHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2OS/c11-9-5-13-10(15-9)6-12-4-7-2-1-3-8(7)14/h5,7-8,12,14H,1-4,6H2.
What are the key properties of 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol?
2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 246.76 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(5-chloro-1,3-thiazol-2-yl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 104879247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).