[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol

C6H10N2OS — CID 83679321

IUPAC[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol
SMILESCc1nc(CN)sc1CO
InChIInChI=1S/C6H10N2OS/c1-4-5(3-9)10-6(2-7)8-4/h9H,2-3,7H2,1H3
InChIKeyMWBFTDDSTGSZSQ-UHFFFAOYSA-N
MW158.23 g/mol
LogP0.40
Rot. Bonds2

About [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol

[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol (PubChem CID 83679321) has the molecular formula C6H10N2OS and a molecular weight of 158.23 g/mol. Its IUPAC name is [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol
PubChem CID83679321
Molecular FormulaC6H10N2OS
Molecular Weight158.23 g/mol
Exact Mass158.05
IUPAC Name[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol
SMILESCc1nc(CN)sc1CO
InChIInChI=1S/C6H10N2OS/c1-4-5(3-9)10-6(2-7)8-4/h9H,2-3,7H2,1H3
InChIKeyMWBFTDDSTGSZSQ-UHFFFAOYSA-N
XLogP0.40
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.23
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]-N-propan-2-ylacetamide
CID 82115304
[5-[(4-ethylphenyl)methyl]-4-methyl-1,3-thiazol-2-yl]methanamine
CID 82054609
2-(2-ethyl-4-methyl-1,3-thiazol-5-yl)ethanamine
CID 79002022
[5-[(2,4-difluorophenyl)methyl]-4-methyl-1,3-thiazol-2-yl]methanamine
CID 82054678
(4,5-diethyl-1,3-thiazol-2-yl)methanamine
CID 105434611
2-[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]-N-(3-methylphenyl)acetamide
CID 94284257
propyl 4-[[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methyl]benzoate
CID 83970145
[4-methyl-5-[(4-pyrrolidin-1-ylphenyl)methyl]-1,3-thiazol-2-yl]methanamine
CID 83970171
5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
CID 24820452
[5-[(2,4-dimethoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-yl]methanamine
CID 83970160
2-[5-(methoxymethyl)-4-methyl-1,3-thiazol-2-yl]ethanamine
CID 62923064
2-[2-(2,2-dimethylpropyl)-4-methyl-1,3-thiazol-5-yl]ethanamine
CID 79154268

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol (CID 83679321) is [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol is Cc1nc(CN)sc1CO.
What is the InChIKey of [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol?
The InChIKey is MWBFTDDSTGSZSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2OS/c1-4-5(3-9)10-6(2-7)8-4/h9H,2-3,7H2,1H3.
What are the key properties of [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol?
[2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol has a molecular weight of 158.23 g/mol, XLogP of 0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)-4-methyl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 83679321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).