(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol

C10H11N3OS — CID 104769588

IUPAC(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol
SMILESCc1csc(C(O)c2cccnc2N)n1
InChIInChI=1S/C10H11N3OS/c1-6-5-15-10(13-6)8(14)7-3-2-4-12-9(7)11/h2-5,8,14H,1H3,(H2,11,12)
InChIKeyPEOXKIRPDPSHRZ-UHFFFAOYSA-N
MW221.29 g/mol
LogP1.51
Rot. Bonds2

About (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol

(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol (PubChem CID 104769588) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol.

Molecular Properties

Compound Name(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol
PubChem CID104769588
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC Name(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol
SMILESCc1csc(C(O)c2cccnc2N)n1
InChIInChI=1S/C10H11N3OS/c1-6-5-15-10(13-6)8(14)7-3-2-4-12-9(7)11/h2-5,8,14H,1H3,(H2,11,12)
InChIKeyPEOXKIRPDPSHRZ-UHFFFAOYSA-N
XLogP1.51
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 51.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol?
The IUPAC name of (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol (CID 104769588) is (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol.
What is the SMILES notation for (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol?
The canonical SMILES for (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol is Cc1csc(C(O)c2cccnc2N)n1.
What is the InChIKey of (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol?
The InChIKey is PEOXKIRPDPSHRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-6-5-15-10(13-6)8(14)7-3-2-4-12-9(7)11/h2-5,8,14H,1H3,(H2,11,12).
What are the key properties of (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol?
(2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol has a molecular weight of 221.29 g/mol, XLogP of 1.51, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-3-pyridinyl)-(4-methyl-1,3-thiazol-2-yl)methanol is sourced from PubChem (CID 104769588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).