[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol

C12H15N3OS — CID 62752453

IUPAC[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCN(CCc1ccccn1)c1ncc(CO)s1
InChIInChI=1S/C12H15N3OS/c1-15(12-14-8-11(9-16)17-12)7-5-10-4-2-3-6-13-10/h2-4,6,8,16H,5,7,9H2,1H3
InChIKeyBFMWAPOFYWTUPW-UHFFFAOYSA-N
MW249.34 g/mol
LogP1.71
Rot. Bonds5

About [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol

[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 62752453) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID62752453
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCN(CCc1ccccn1)c1ncc(CO)s1
InChIInChI=1S/C12H15N3OS/c1-15(12-14-8-11(9-16)17-12)7-5-10-4-2-3-6-13-10/h2-4,6,8,16H,5,7,9H2,1H3
InChIKeyBFMWAPOFYWTUPW-UHFFFAOYSA-N
XLogP1.71
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[methyl(2-thiophen-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 79494341
[5-[methyl(2-pyridin-2-ylethyl)amino]pyrazin-2-yl]methanol
CID 107372677
N-methyl-5-propan-2-yl-N-(2-pyridin-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 133381833
N-methyl-5-pyridin-2-yl-N-(2-pyridin-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 133466920
N-methyl-N-(2-pyridin-2-ylethyl)-[1,3]thiazolo[4,5-c]pyridin-2-amine
CID 166601640
N-methyl-N-(2-pyridin-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 166600998
[6-[methyl(2-pyridin-2-ylethyl)amino]pyridazin-3-yl]methanol
CID 61256234
1-[4-methyl-2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]ethanol
CID 62752452
[2-[methyl(2-pyridin-2-ylethyl)amino]-4-pyridinyl]methanol
CID 61256233
N-methyl-2-pyridin-2-yl-N-trimethylsilylethanamine
CID 91709658
1-[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-4-yl]ethanol
CID 64543792
3-[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-4-yl]propanoic acid
CID 103486086

Frequently Asked Questions

What is the IUPAC name of [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol (CID 62752453) is [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol is CN(CCc1ccccn1)c1ncc(CO)s1.
What is the InChIKey of [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is BFMWAPOFYWTUPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-15(12-14-8-11(9-16)17-12)7-5-10-4-2-3-6-13-10/h2-4,6,8,16H,5,7,9H2,1H3.
What are the key properties of [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
[2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 249.34 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[methyl(2-pyridin-2-ylethyl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 62752453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).