[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone

C16H18N2O4S — CID 24712991

IUPAC[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone
SMILESCOc1ccccc1OCc1nc(C(=O)N2CCOCC2)cs1
InChIInChI=1S/C16H18N2O4S/c1-20-13-4-2-3-5-14(13)22-10-15-17-12(11-23-15)16(19)18-6-8-21-9-7-18/h2-5,11H,6-10H2,1H3
InChIKeyZHXJPNZKLNNWQT-UHFFFAOYSA-N
MW334.40 g/mol
LogP2.20
Rot. Bonds5

About [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone

[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone (PubChem CID 24712991) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone
PubChem CID24712991
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC Name[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone
SMILESCOc1ccccc1OCc1nc(C(=O)N2CCOCC2)cs1
InChIInChI=1S/C16H18N2O4S/c1-20-13-4-2-3-5-14(13)22-10-15-17-12(11-23-15)16(19)18-6-8-21-9-7-18/h2-5,11H,6-10H2,1H3
InChIKeyZHXJPNZKLNNWQT-UHFFFAOYSA-N
XLogP2.20
TPSA60.89 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone (CID 24712991) is [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone is COc1ccccc1OCc1nc(C(=O)N2CCOCC2)cs1.
What is the InChIKey of [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone?
The InChIKey is ZHXJPNZKLNNWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c1-20-13-4-2-3-5-14(13)22-10-15-17-12(11-23-15)16(19)18-6-8-21-9-7-18/h2-5,11H,6-10H2,1H3.
What are the key properties of [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone?
[2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone has a molecular weight of 334.40 g/mol, XLogP of 2.20, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methoxyphenoxy)methyl]-1,3-thiazol-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 24712991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).