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

C12H20N2OS — CID 115360729

IUPAC[1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
SMILESCCc1csc(NCC2(CO)CCCC2)n1
InChIInChI=1S/C12H20N2OS/c1-2-10-7-16-11(14-10)13-8-12(9-15)5-3-4-6-12/h7,15H,2-6,8-9H2,1H3,(H,13,14)
InChIKeyVNKIKZGFFXVWKN-UHFFFAOYSA-N
MW240.37 g/mol
LogP2.67
Rot. Bonds5

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

[1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol (PubChem CID 115360729) has the molecular formula C12H20N2OS and a molecular weight of 240.37 g/mol. Its IUPAC name is [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
PubChem CID115360729
Molecular FormulaC12H20N2OS
Molecular Weight240.37 g/mol
Exact Mass240.13
IUPAC Name[1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol
SMILESCCc1csc(NCC2(CO)CCCC2)n1
InChIInChI=1S/C12H20N2OS/c1-2-10-7-16-11(14-10)13-8-12(9-15)5-3-4-6-12/h7,15H,2-6,8-9H2,1H3,(H,13,14)
InChIKeyVNKIKZGFFXVWKN-UHFFFAOYSA-N
XLogP2.67
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.37
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol with MolForge

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Related Compounds

[1-[[(3-ethyl-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentyl]methanol
CID 115360719
[1-[[(4-methyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]methanol
CID 115455218
methyl 2-[2-[[1-(2-methylpropyl)cyclopentyl]methylamino]-1,3-thiazol-4-yl]acetate
CID 80574480
[1-[[(3-methyl-1,2,4-thiadiazol-5-yl)amino]methyl]cyclopentyl]methanol
CID 115360758
3-[2-[(1-methylcyclopentyl)methylamino]-1,3-thiazol-4-yl]propanoic acid
CID 103487564
[1-[[(6-ethylpyrimidin-4-yl)amino]methyl]cyclohexyl]methanol
CID 112697562
2-[(4-ethyl-1,3-thiazol-2-yl)amino]acetic acid
CID 62960794
4-[(4-ethyl-1,3-thiazol-2-yl)amino]butan-1-ol
CID 106842633
[1-[(4-ethyl-1,3-thiazol-2-yl)methyl]cyclopropyl]methanol
CID 116969329
2-[2-[[1-(dimethylamino)cyclobutyl]methylamino]-1,3-thiazol-4-yl]acetic acid
CID 105420721
6-[(4-ethyl-1,3-thiazol-2-yl)amino]hexan-1-ol
CID 103918134
[1-[[(5-methyl-1,3-thiazol-2-yl)amino]methyl]cyclobutyl]methanol
CID 131204109

Frequently Asked Questions

What is the IUPAC name of [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol (CID 115360729) is [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol is CCc1csc(NCC2(CO)CCCC2)n1.
What is the InChIKey of [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
The InChIKey is VNKIKZGFFXVWKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2OS/c1-2-10-7-16-11(14-10)13-8-12(9-15)5-3-4-6-12/h7,15H,2-6,8-9H2,1H3,(H,13,14).
What are the key properties of [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol?
[1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol has a molecular weight of 240.37 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(4-ethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 115360729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).