(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol

C8H10N4OS — CID 130670447

IUPAC(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol
SMILESCn1ncc(C(O)c2cscn2)c1N
InChIInChI=1S/C8H10N4OS/c1-12-8(9)5(2-11-12)7(13)6-3-14-4-10-6/h2-4,7,13H,9H2,1H3
InChIKeyNYLJTWMQSIQFFT-UHFFFAOYSA-N
MW210.26 g/mol
LogP0.54
Rot. Bonds2

About (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol

(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol (PubChem CID 130670447) has the molecular formula C8H10N4OS and a molecular weight of 210.26 g/mol. Its IUPAC name is (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol.

Molecular Properties

Compound Name(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol
PubChem CID130670447
Molecular FormulaC8H10N4OS
Molecular Weight210.26 g/mol
Exact Mass210.06
IUPAC Name(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol
SMILESCn1ncc(C(O)c2cscn2)c1N
InChIInChI=1S/C8H10N4OS/c1-12-8(9)5(2-11-12)7(13)6-3-14-4-10-6/h2-4,7,13H,9H2,1H3
InChIKeyNYLJTWMQSIQFFT-UHFFFAOYSA-N
XLogP0.54
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(1,4-dimethylpyrazol-5-yl)-(1,3-thiazol-4-yl)methanamine
CID 130527433
(5-amino-1-methylpyrazol-4-yl)-(4-methylphenyl)methanol
CID 65362027
(3-methyltriazol-4-yl)-(1,3-thiazol-4-yl)methanamine
CID 114688732
(2-amino-5-chloro-3-pyridinyl)-(5-amino-1-methylpyrazol-4-yl)methanol
CID 65362465
(5-amino-1-methylpyrazol-4-yl)-(4-methoxyphenyl)methanol
CID 65362246
1,3-thiazol-4-ylmethanediol
CID 59870088
(3-fluoro-4-pyridinyl)-(1,3-thiazol-4-yl)methanol
CID 104738089
(5-amino-1-methylpyrazol-4-yl)-(5-methyl-1-benzofuran-2-yl)methanol
CID 114726654
(4-chloro-1-ethylpyrazol-5-yl)-(1,3-thiazol-4-yl)methanol
CID 114638381
(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol
CID 116505787
(2-ethylfuran-3-yl)-(1,3-thiazol-4-yl)methanol
CID 131020969
(1S)-2-methyl-1-(1,3-thiazol-4-yl)propan-1-amine
CID 82416070

Frequently Asked Questions

What is the IUPAC name of (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol?
The IUPAC name of (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol (CID 130670447) is (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol.
What is the SMILES notation for (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol?
The canonical SMILES for (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol is Cn1ncc(C(O)c2cscn2)c1N.
What is the InChIKey of (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol?
The InChIKey is NYLJTWMQSIQFFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4OS/c1-12-8(9)5(2-11-12)7(13)6-3-14-4-10-6/h2-4,7,13H,9H2,1H3.
What are the key properties of (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol?
(5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol has a molecular weight of 210.26 g/mol, XLogP of 0.54, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-1-methylpyrazol-4-yl)-(1,3-thiazol-4-yl)methanol is sourced from PubChem (CID 130670447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).