(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine

C10H11N3S — CID 39240932

IUPAC(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine
SMILESCc1nc(CN)sc1-c1ccccn1
InChIInChI=1S/C10H11N3S/c1-7-10(14-9(6-11)13-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3
InChIKeySZESXDOCHKRIEU-UHFFFAOYSA-N
MW205.29 g/mol
LogP1.97
Rot. Bonds2

About (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine

(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine (PubChem CID 39240932) has the molecular formula C10H11N3S and a molecular weight of 205.29 g/mol. Its IUPAC name is (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine.

Molecular Properties

Compound Name(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine
PubChem CID39240932
Molecular FormulaC10H11N3S
Molecular Weight205.29 g/mol
Exact Mass205.07
IUPAC Name(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine
SMILESCc1nc(CN)sc1-c1ccccn1
InChIInChI=1S/C10H11N3S/c1-7-10(14-9(6-11)13-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3
InChIKeySZESXDOCHKRIEU-UHFFFAOYSA-N
XLogP1.97
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.29
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine?
The IUPAC name of (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine (CID 39240932) is (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine.
What is the SMILES notation for (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine?
The canonical SMILES for (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine is Cc1nc(CN)sc1-c1ccccn1.
What is the InChIKey of (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine?
The InChIKey is SZESXDOCHKRIEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3S/c1-7-10(14-9(6-11)13-7)8-4-2-3-5-12-8/h2-5H,6,11H2,1H3.
What are the key properties of (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine?
(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine has a molecular weight of 205.29 g/mol, XLogP of 1.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)methanamine is sourced from PubChem (CID 39240932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).