N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine

C12H16N2O2S — CID 126726064

IUPACN-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCCN(CCOC)c1nc(-c2ccco2)cs1
InChIInChI=1S/C12H16N2O2S/c1-3-14(6-8-15-2)12-13-10(9-17-12)11-5-4-7-16-11/h4-5,7,9H,3,6,8H2,1-2H3
InChIKeyQQGFVRURTJYSGL-UHFFFAOYSA-N
MW252.34 g/mol
LogP2.88
Rot. Bonds6

About N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine

N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine (PubChem CID 126726064) has the molecular formula C12H16N2O2S and a molecular weight of 252.34 g/mol. Its IUPAC name is N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
PubChem CID126726064
Molecular FormulaC12H16N2O2S
Molecular Weight252.34 g/mol
Exact Mass252.09
IUPAC NameN-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine
SMILESCCN(CCOC)c1nc(-c2ccco2)cs1
InChIInChI=1S/C12H16N2O2S/c1-3-14(6-8-15-2)12-13-10(9-17-12)11-5-4-7-16-11/h4-5,7,9H,3,6,8H2,1-2H3
InChIKeyQQGFVRURTJYSGL-UHFFFAOYSA-N
XLogP2.88
TPSA38.50 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine (CID 126726064) is N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine is CCN(CCOC)c1nc(-c2ccco2)cs1.
What is the InChIKey of N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
The InChIKey is QQGFVRURTJYSGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2S/c1-3-14(6-8-15-2)12-13-10(9-17-12)11-5-4-7-16-11/h4-5,7,9H,3,6,8H2,1-2H3.
What are the key properties of N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine?
N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine has a molecular weight of 252.34 g/mol, XLogP of 2.88, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-(furan-2-yl)-N-(2-methoxyethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 126726064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).