[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine

C9H14N2OS — CID 130583812

IUPAC[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine
SMILESNCC1CCCC(c2nccs2)O1
InChIInChI=1S/C9H14N2OS/c10-6-7-2-1-3-8(12-7)9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2
InChIKeyGOGPTNATDCQLLU-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.71
Rot. Bonds2

About [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine

[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine (PubChem CID 130583812) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine.

Molecular Properties

Compound Name[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine
PubChem CID130583812
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine
SMILESNCC1CCCC(c2nccs2)O1
InChIInChI=1S/C9H14N2OS/c10-6-7-2-1-3-8(12-7)9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2
InChIKeyGOGPTNATDCQLLU-UHFFFAOYSA-N
XLogP1.71
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[(2S,5R)-5-(aminomethyl)oxolan-2-yl]-[4-(1,3-thiazol-2-yl)piperidin-1-yl]methanone;dihydrochloride
CID 120799663
[4-(1,3-thiazol-2-yl)cyclohexyl]methanamine;hydrochloride
CID 158523431
[5-(5-iodo-1,3-thiazol-2-yl)oxolan-2-yl]methanamine
CID 126983724
[6-(5-methylthiophen-2-yl)oxan-2-yl]methanamine
CID 130583755
(5S)-5-(1,3-thiazol-2-yl)oxolan-2-one
CID 71354365
(2S,5R)-5-(aminomethyl)-N-[1-(1,3-thiazol-2-yl)cyclopentyl]oxolane-2-carboxamide;dihydrochloride
CID 120800829
N-[[5-(aminomethyl)oxolan-2-yl]methyl]-2-(1,3-thiazol-2-yl)propan-1-amine
CID 114128154
1-[(2S,5R)-5-(aminomethyl)oxolane-2-carbonyl]-N-(1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 120798506
2-[(2R)-pyrrolidin-2-yl]-1,3-thiazole
CID 7047975
[6-methyl-4-(1,3-thiazol-2-yl)morpholin-2-yl]methanamine
CID 102938684
[5-(2-methyl-1,3-thiazol-4-yl)oxolan-2-yl]methanamine
CID 130583609
[6-(2-chlorothiophen-3-yl)oxan-2-yl]methanol
CID 131052682

Frequently Asked Questions

What is the IUPAC name of [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine?
The IUPAC name of [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine (CID 130583812) is [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine.
What is the SMILES notation for [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine?
The canonical SMILES for [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine is NCC1CCCC(c2nccs2)O1.
What is the InChIKey of [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine?
The InChIKey is GOGPTNATDCQLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c10-6-7-2-1-3-8(12-7)9-11-4-5-13-9/h4-5,7-8H,1-3,6,10H2.
What are the key properties of [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine?
[6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine has a molecular weight of 198.29 g/mol, XLogP of 1.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1,3-thiazol-2-yl)oxan-2-yl]methanamine is sourced from PubChem (CID 130583812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).