4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol

C10H18N2OS — CID 104772051

IUPAC4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol
SMILESCc1csc(C(CCO)C(C)(C)N)n1
InChIInChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(4-5-13)10(2,3)11/h6,8,13H,4-5,11H2,1-3H3
InChIKeyBTYIEYJEYXBYIQ-UHFFFAOYSA-N
MW214.33 g/mol
LogP1.65
Rot. Bonds4

About 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol

4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol (PubChem CID 104772051) has the molecular formula C10H18N2OS and a molecular weight of 214.33 g/mol. Its IUPAC name is 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol.

Molecular Properties

Compound Name4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol
PubChem CID104772051
Molecular FormulaC10H18N2OS
Molecular Weight214.33 g/mol
Exact Mass214.11
IUPAC Name4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol
SMILESCc1csc(C(CCO)C(C)(C)N)n1
InChIInChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(4-5-13)10(2,3)11/h6,8,13H,4-5,11H2,1-3H3
InChIKeyBTYIEYJEYXBYIQ-UHFFFAOYSA-N
XLogP1.65
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.33
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-1-(4-methyl-1,3-thiazol-2-yl)propan-1-ol
CID 124594880
(1S)-1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine
CID 42078005
1-(4-methyl-1,3-thiazol-2-yl)ethanamine;hydrochloride
CID 73012335
4-methyl-2-pentan-2-yl-1,3-thiazole
CID 138644100
(1R)-2,2,2-trifluoro-1-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 9267875
(1S)-3,3,3-trifluoro-1-(4-methyl-1,3-thiazol-2-yl)propan-1-amine
CID 104941052
1-(4-methyl-1,3-thiazol-2-yl)hexan-1-ol
CID 104769495
3-amino-3-methyl-1-(4-methyl-1,3-thiazol-2-yl)butan-2-ol
CID 130589293
2-ethyl-2-[[1-(4-methyl-1,3-thiazol-2-yl)ethylamino]methyl]butan-1-ol
CID 81419564
4-amino-3-(3-tert-butyl-1-methylpyrazol-4-yl)-4-methylpentan-1-ol
CID 83094621
2-ethyl-1-(4-methyl-1,3-thiazol-2-yl)butan-1-amine
CID 61333036
2-methyl-5-[(4-methyl-1,3-thiazol-2-yl)amino]pentan-1-ol
CID 106158680

Frequently Asked Questions

What is the IUPAC name of 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol?
The IUPAC name of 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol (CID 104772051) is 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol.
What is the SMILES notation for 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol?
The canonical SMILES for 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol is Cc1csc(C(CCO)C(C)(C)N)n1.
What is the InChIKey of 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol?
The InChIKey is BTYIEYJEYXBYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2OS/c1-7-6-14-9(12-7)8(4-5-13)10(2,3)11/h6,8,13H,4-5,11H2,1-3H3.
What are the key properties of 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol?
4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol has a molecular weight of 214.33 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-4-methyl-3-(4-methyl-1,3-thiazol-2-yl)pentan-1-ol is sourced from PubChem (CID 104772051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).