3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride

C18H23ClN2O3S — CID 52984959

IUPAC3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
SMILESCOc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.Cl
InChIInChI=1S/C18H22N2O3S.ClH/c1-22-15-5-2-4-14(12-15)18(21)19-13-16(17-6-3-11-24-17)20-7-9-23-10-8-20;/h2-6,11-12,16H,7-10,13H2,1H3,(H,19,21);1H
InChIKeyHIWAOODHERMYBB-UHFFFAOYSA-N
MW382.91 g/mol
LogP2.98
Rot. Bonds6

About 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride

3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride (PubChem CID 52984959) has the molecular formula C18H23ClN2O3S and a molecular weight of 382.91 g/mol. Its IUPAC name is 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride.

Molecular Properties

Compound Name3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
PubChem CID52984959
Molecular FormulaC18H23ClN2O3S
Molecular Weight382.91 g/mol
Exact Mass382.11
IUPAC Name3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride
SMILESCOc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.Cl
InChIInChI=1S/C18H22N2O3S.ClH/c1-22-15-5-2-4-14(12-15)18(21)19-13-16(17-6-3-11-24-17)20-7-9-23-10-8-20;/h2-6,11-12,16H,7-10,13H2,1H3,(H,19,21);1H
InChIKeyHIWAOODHERMYBB-UHFFFAOYSA-N
XLogP2.98
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.91
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride?
The IUPAC name of 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride (CID 52984959) is 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride.
What is the SMILES notation for 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride?
The canonical SMILES for 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride is COc1cccc(C(=O)NCC(c2cccs2)N2CCOCC2)c1.Cl.
What is the InChIKey of 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride?
The InChIKey is HIWAOODHERMYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S.ClH/c1-22-15-5-2-4-14(12-15)18(21)19-13-16(17-6-3-11-24-17)20-7-9-23-10-8-20;/h2-6,11-12,16H,7-10,13H2,1H3,(H,19,21);1H.
What are the key properties of 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride?
3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride has a molecular weight of 382.91 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide;hydrochloride is sourced from PubChem (CID 52984959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).