[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol

C10H15ClN2OS — CID 83152429

IUPAC[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
SMILESOCC1CCCC1CNc1nc(Cl)cs1
InChIInChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-4-7-2-1-3-8(7)5-14/h6-8,14H,1-5H2,(H,12,13)
InChIKeyJXOBYALDNWDWNZ-UHFFFAOYSA-N
MW246.76 g/mol
LogP2.62
Rot. Bonds4

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

[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol (PubChem CID 83152429) 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]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
PubChem CID83152429
Molecular FormulaC10H15ClN2OS
Molecular Weight246.76 g/mol
Exact Mass246.06
IUPAC Name[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
SMILESOCC1CCCC1CNc1nc(Cl)cs1
InChIInChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-4-7-2-1-3-8(7)5-14/h6-8,14H,1-5H2,(H,12,13)
InChIKeyJXOBYALDNWDWNZ-UHFFFAOYSA-N
XLogP2.62
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 ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol (CID 83152429) is [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol is OCC1CCCC1CNc1nc(Cl)cs1.
What is the InChIKey of [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The InChIKey is JXOBYALDNWDWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2OS/c11-9-6-15-10(13-9)12-4-7-2-1-3-8(7)5-14/h6-8,14H,1-5H2,(H,12,13).
What are the key properties of [2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
[2-[[(4-chloro-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol has a molecular weight of 246.76 g/mol, XLogP of 2.62, 4 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]cyclopentyl]methanol is sourced from PubChem (CID 83152429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).