4-(1,2-thiazol-3-yl)oxan-4-amine

C8H12N2OS — CID 131214101

IUPAC4-(1,2-thiazol-3-yl)oxan-4-amine
SMILESNC1(c2ccsn2)CCOCC1
InChIInChI=1S/C8H12N2OS/c9-8(2-4-11-5-3-8)7-1-6-12-10-7/h1,6H,2-5,9H2
InChIKeyFDNIVNZJFWSGHD-UHFFFAOYSA-N
MW184.26 g/mol
LogP1.11
Rot. Bonds1

About 4-(1,2-thiazol-3-yl)oxan-4-amine

4-(1,2-thiazol-3-yl)oxan-4-amine (PubChem CID 131214101) has the molecular formula C8H12N2OS and a molecular weight of 184.26 g/mol. Its IUPAC name is 4-(1,2-thiazol-3-yl)oxan-4-amine.

Molecular Properties

Compound Name4-(1,2-thiazol-3-yl)oxan-4-amine
PubChem CID131214101
Molecular FormulaC8H12N2OS
Molecular Weight184.26 g/mol
Exact Mass184.07
IUPAC Name4-(1,2-thiazol-3-yl)oxan-4-amine
SMILESNC1(c2ccsn2)CCOCC1
InChIInChI=1S/C8H12N2OS/c9-8(2-4-11-5-3-8)7-1-6-12-10-7/h1,6H,2-5,9H2
InChIKeyFDNIVNZJFWSGHD-UHFFFAOYSA-N
XLogP1.11
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Methyl 3-amino-3-(1,2-thiazol-3-yl)butanoate
CID 122538058
methyl (3S)-3-amino-3-(1,2-thiazol-3-yl)butanoate
CID 122538059
4-(1,2-Thiazol-3-yl)oxepan-4-amine
CID 127002573
(3-Methyloxan-4-yl)-(1,2-thiazol-3-yl)methanamine
CID 130604775
Oxolan-3-yl(1,2-thiazol-3-yl)methanamine
CID 130664721
3-(1,2-Thiazol-3-yl)oxan-3-amine
CID 130721975
3-Methoxy-1-(1,2-thiazol-3-yl)propan-1-amine
CID 131206607

Frequently Asked Questions

What is the IUPAC name of 4-(1,2-thiazol-3-yl)oxan-4-amine?
The IUPAC name of 4-(1,2-thiazol-3-yl)oxan-4-amine (CID 131214101) is 4-(1,2-thiazol-3-yl)oxan-4-amine.
What is the SMILES notation for 4-(1,2-thiazol-3-yl)oxan-4-amine?
The canonical SMILES for 4-(1,2-thiazol-3-yl)oxan-4-amine is NC1(c2ccsn2)CCOCC1.
What is the InChIKey of 4-(1,2-thiazol-3-yl)oxan-4-amine?
The InChIKey is FDNIVNZJFWSGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2OS/c9-8(2-4-11-5-3-8)7-1-6-12-10-7/h1,6H,2-5,9H2.
What are the key properties of 4-(1,2-thiazol-3-yl)oxan-4-amine?
4-(1,2-thiazol-3-yl)oxan-4-amine has a molecular weight of 184.26 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2-thiazol-3-yl)oxan-4-amine is sourced from PubChem (CID 131214101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).