(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol

C10H12N2OS — CID 11600915

IUPAC(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol
SMILESCc1ccsc1C(O)c1ccnn1C
InChIInChI=1S/C10H12N2OS/c1-7-4-6-14-10(7)9(13)8-3-5-11-12(8)2/h3-6,9,13H,1-2H3
InChIKeyMNAKXMOJCYLOGE-UHFFFAOYSA-N
MW208.29 g/mol
LogP1.87
Rot. Bonds2

About (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol

(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol (PubChem CID 11600915) has the molecular formula C10H12N2OS and a molecular weight of 208.29 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol
PubChem CID11600915
Molecular FormulaC10H12N2OS
Molecular Weight208.29 g/mol
Exact Mass208.07
IUPAC Name(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol
SMILESCc1ccsc1C(O)c1ccnn1C
InChIInChI=1S/C10H12N2OS/c1-7-4-6-14-10(7)9(13)8-3-5-11-12(8)2/h3-6,9,13H,1-2H3
InChIKeyMNAKXMOJCYLOGE-UHFFFAOYSA-N
XLogP1.87
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.29
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol?
The IUPAC name of (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol (CID 11600915) is (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol.
What is the SMILES notation for (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol?
The canonical SMILES for (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol is Cc1ccsc1C(O)c1ccnn1C.
What is the InChIKey of (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol?
The InChIKey is MNAKXMOJCYLOGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2OS/c1-7-4-6-14-10(7)9(13)8-3-5-11-12(8)2/h3-6,9,13H,1-2H3.
What are the key properties of (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol?
(2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol has a molecular weight of 208.29 g/mol, XLogP of 1.87, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-(3-methylthiophen-2-yl)methanol is sourced from PubChem (CID 11600915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).