2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol

C11H18N2OS — CID 114749702

IUPAC2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol
SMILESCc1nc(NCC2(CCO)CC2)sc1C
InChIInChI=1S/C11H18N2OS/c1-8-9(2)15-10(13-8)12-7-11(3-4-11)5-6-14/h14H,3-7H2,1-2H3,(H,12,13)
InChIKeyLWYSKSSRPLDARI-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.33
Rot. Bonds5

About 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol

2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol (PubChem CID 114749702) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol
PubChem CID114749702
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol
SMILESCc1nc(NCC2(CCO)CC2)sc1C
InChIInChI=1S/C11H18N2OS/c1-8-9(2)15-10(13-8)12-7-11(3-4-11)5-6-14/h14H,3-7H2,1-2H3,(H,12,13)
InChIKeyLWYSKSSRPLDARI-UHFFFAOYSA-N
XLogP2.33
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol with MolForge

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Related Compounds

4-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]butan-2-ol
CID 65168391
1-Cyclopropyl-2-[(4,5-dimethyl-1,3-thiazol-2-yl)amino]ethanol
CID 65168445
3-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]-2-methylpropan-1-ol
CID 65168449
1-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]-2-methylbutan-2-ol
CID 65168452
3-[[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]methyl]pentan-3-ol
CID 65168505
1-[[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopentan-1-ol
CID 65168506
4,5-dimethyl-N-(oxan-4-ylmethyl)-1,3-thiazol-2-amine
CID 65168555
2-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]-2-ethylbutan-1-ol
CID 65168722
3-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]propan-1-ol
CID 65169320
2-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]butan-1-ol
CID 65169536
4-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]cyclohexan-1-ol
CID 65169586
2-[(4,5-Dimethyl-1,3-thiazol-2-yl)amino]-4-methylpentan-1-ol
CID 65169596

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol (CID 114749702) is 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol is Cc1nc(NCC2(CCO)CC2)sc1C.
What is the InChIKey of 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol?
The InChIKey is LWYSKSSRPLDARI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8-9(2)15-10(13-8)12-7-11(3-4-11)5-6-14/h14H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol?
2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol has a molecular weight of 226.34 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[(4,5-dimethyl-1,3-thiazol-2-yl)amino]methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114749702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).