N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine

C10H16N2OS — CID 116811952

IUPACN-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(C2CCCOC2)s1
InChIInChI=1S/C10H16N2OS/c1-2-11-10-12-6-9(14-10)8-4-3-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12)
InChIKeyZMCUQWQESJRVIB-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.47
Rot. Bonds3

About N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine

N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine (PubChem CID 116811952) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine
PubChem CID116811952
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine
SMILESCCNc1ncc(C2CCCOC2)s1
InChIInChI=1S/C10H16N2OS/c1-2-11-10-12-6-9(14-10)8-4-3-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12)
InChIKeyZMCUQWQESJRVIB-UHFFFAOYSA-N
XLogP2.47
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-cyclobutyl-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 116812328
N-ethyl-5-(oxan-4-yloxymethyl)-1,3-thiazol-2-amine
CID 79774031
5-[(3R)-oxolan-3-yl]-1,3-thiazol-2-amine
CID 124595055
5-[(3S)-oxolan-3-yl]-1,3-thiazol-2-amine
CID 124595056
5-(cyclopentyloxymethyl)-N-ethyl-1,3-thiazol-2-amine
CID 79773903
N-ethyl-2-(oxan-3-yl)-6-propylpyrimidin-4-amine
CID 63739311
3-[5-(oxolan-3-yl)-1,3-thiazol-2-yl]propanoic acid
CID 115036151
N-[[5-(oxan-3-yl)-1,3-oxazol-2-yl]methyl]propan-2-amine
CID 65183813
5-(4-methylcyclohexyl)-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 116812288
N-[[5-(oxan-3-yl)-1,3-oxazol-2-yl]methyl]propan-1-amine
CID 65183995
N-ethyl-5-iodo-6-methyl-2-(oxan-3-yl)pyrimidin-4-amine
CID 66305719
5-bromo-N-ethyl-6-methyl-2-(oxan-3-yl)pyrimidin-4-amine
CID 66307264

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine (CID 116811952) is N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine is CCNc1ncc(C2CCCOC2)s1.
What is the InChIKey of N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine?
The InChIKey is ZMCUQWQESJRVIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-2-11-10-12-6-9(14-10)8-4-3-5-13-7-8/h6,8H,2-5,7H2,1H3,(H,11,12).
What are the key properties of N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine?
N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine has a molecular weight of 212.32 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-(oxan-3-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 116811952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).