N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine

C9H14N2OS — CID 63333370

IUPACN-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine
SMILESCCNC1(c2nccs2)CCOC1
InChIInChI=1S/C9H14N2OS/c1-2-11-9(3-5-12-7-9)8-10-4-6-13-8/h4,6,11H,2-3,5,7H2,1H3
InChIKeyPXLMWFUMIODGKM-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.37
Rot. Bonds3

About N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine

N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine (PubChem CID 63333370) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine.

Molecular Properties

Compound NameN-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine
PubChem CID63333370
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC NameN-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine
SMILESCCNC1(c2nccs2)CCOC1
InChIInChI=1S/C9H14N2OS/c1-2-11-9(3-5-12-7-9)8-10-4-6-13-8/h4,6,11H,2-3,5,7H2,1H3
InChIKeyPXLMWFUMIODGKM-UHFFFAOYSA-N
XLogP1.37
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(Pyrrolidin-3-yloxy)methyl]-1,3-thiazole
CID 75356563
3-(1,3-Thiazol-2-yl)oxetan-3-amine hydrochloride
CID 86674782
Methyl 2-[2-(1,3-thiazol-2-yl)butan-2-ylamino]acetate
CID 71868948
4-(1,3-Thiazol-2-yl)oxan-4-amine
CID 61330275
3-(1,3-Thiazol-2-yl)oxetan-3-amine
CID 67481694
1-(1,3-thiazol-2-yl)-N-[3-(2,2,2-trifluoroethoxy)propyl]propan-1-amine
CID 64481599
1-(1,3-thiazol-2-yl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]ethanamine
CID 64481834
1-(1,3-thiazol-2-yl)-N-[2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine
CID 64482001
1-(1,3-thiazol-2-yl)-N-[2-(trifluoromethoxy)ethyl]propan-1-amine
CID 65803858
1-(1,3-thiazol-2-yl)-N-[2-(trifluoromethoxy)ethyl]ethanamine
CID 65803859
N-[2-(2,2-difluoroethoxy)ethyl]-1-(1,3-thiazol-2-yl)ethanamine
CID 102978104
N-methyl-1-(1,3-thiazol-2-yl)-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103215883

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine?
The IUPAC name of N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine (CID 63333370) is N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine.
What is the SMILES notation for N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine?
The canonical SMILES for N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine is CCNC1(c2nccs2)CCOC1.
What is the InChIKey of N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine?
The InChIKey is PXLMWFUMIODGKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-2-11-9(3-5-12-7-9)8-10-4-6-13-8/h4,6,11H,2-3,5,7H2,1H3.
What are the key properties of N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine?
N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine has a molecular weight of 198.29 g/mol, XLogP of 1.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-(1,3-thiazol-2-yl)oxolan-3-amine is sourced from PubChem (CID 63333370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).