1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol

C11H17NOS — CID 130690383

IUPAC1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol
SMILESCCC(O)(c1csc(C)n1)C1CC1C
InChIInChI=1S/C11H17NOS/c1-4-11(13,9-5-7(9)2)10-6-14-8(3)12-10/h6-7,9,13H,4-5H2,1-3H3
InChIKeyIMJDCXWTRWTXCM-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.71
Rot. Bonds3

About 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol

1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol (PubChem CID 130690383) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol
PubChem CID130690383
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol
SMILESCCC(O)(c1csc(C)n1)C1CC1C
InChIInChI=1S/C11H17NOS/c1-4-11(13,9-5-7(9)2)10-6-14-8(3)12-10/h6-7,9,13H,4-5H2,1-3H3
InChIKeyIMJDCXWTRWTXCM-UHFFFAOYSA-N
XLogP2.71
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-4-(2-methylbutan-2-yl)-1,3-thiazole
CID 130586456
1-(2-methylcyclopropyl)-1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine
CID 130698574
N-[(3-methylcyclohexyl)methyl]-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 103883909
3-[[(2-methyl-1,3-thiazol-4-yl)methylamino]methyl]cyclobutan-1-ol
CID 66006508
2-ethyl-2-[2-[(2-methylcyclopropyl)methylamino]-1,3-thiazol-4-yl]butanoic acid
CID 112752487
N-methyl-2-(2-methyl-1,3-thiazol-4-yl)propan-2-amine
CID 82598274
cis-(1R,2S)-4-ethyl-2-[2-(2-methyl-1,3-thiazol-4-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 106032480
[3-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]cyclobutyl]methanamine
CID 164652953
4-ethyl-2-methyl-1,3-thiazole;hydrochloride
CID 141419064
1-(3,4-dimethylcyclohexyl)-2-(2-methyl-1,3-thiazol-4-yl)ethanol
CID 64740229
2-[(1S,2S)-2-methylcyclopropyl]propan-2-ol
CID 167340222
N-(2-hydroxy-2-methylbutyl)-2-methyl-1,3-thiazole-4-carboxamide
CID 65198788

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol?
The IUPAC name of 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol (CID 130690383) is 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol.
What is the SMILES notation for 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol?
The canonical SMILES for 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol is CCC(O)(c1csc(C)n1)C1CC1C.
What is the InChIKey of 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol?
The InChIKey is IMJDCXWTRWTXCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-4-11(13,9-5-7(9)2)10-6-14-8(3)12-10/h6-7,9,13H,4-5H2,1-3H3.
What are the key properties of 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol?
1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol has a molecular weight of 211.33 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopropyl)-1-(2-methyl-1,3-thiazol-4-yl)propan-1-ol is sourced from PubChem (CID 130690383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).