3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide

C19H17ClN2O3S — CID 55777696

IUPAC3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)CCc2ccc(Cl)s2)cc1
InChIInChI=1S/C19H17ClN2O3S/c1-24-13-4-6-14(7-5-13)25-19-16(3-2-12-21-19)22-18(23)11-9-15-8-10-17(20)26-15/h2-8,10,12H,9,11H2,1H3,(H,22,23)
InChIKeyFPCXIZHZLQLRNI-UHFFFAOYSA-N
MW388.88 g/mol
LogP5.17
Rot. Bonds7

About 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide

3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide (PubChem CID 55777696) has the molecular formula C19H17ClN2O3S and a molecular weight of 388.88 g/mol. Its IUPAC name is 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide.

Molecular Properties

Compound Name3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide
PubChem CID55777696
Molecular FormulaC19H17ClN2O3S
Molecular Weight388.88 g/mol
Exact Mass388.06
IUPAC Name3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)CCc2ccc(Cl)s2)cc1
InChIInChI=1S/C19H17ClN2O3S/c1-24-13-4-6-14(7-5-13)25-19-16(3-2-12-21-19)22-18(23)11-9-15-8-10-17(20)26-15/h2-8,10,12H,9,11H2,1H3,(H,22,23)
InChIKeyFPCXIZHZLQLRNI-UHFFFAOYSA-N
XLogP5.17
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.88
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide
CID 55763892
N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 154411578
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 55661128
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-pyrrol-1-ylphenyl)acetamide
CID 55764141
4-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]butanamide
CID 55661422
3-(5,6-dimethyl-4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide
CID 55661375
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-3-(4-piperidin-1-ylsulfonylphenyl)propanamide
CID 55661313
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(2,2,2-trifluoroethoxy)acetamide
CID 55763297
5-chloro-N-(2-phenoxy-3-pyridinyl)thiophene-2-carboxamide
CID 43068513
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-3-(4-oxo-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-3-yl)propanamide
CID 55661241
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-pyrimidin-2-yl-1,3-thiazole-4-carboxamide
CID 55873301
1-[(2S)-4-hydroxybutan-2-yl]-3-[2-(4-methoxyphenoxy)-3-pyridinyl]urea
CID 95981174

Frequently Asked Questions

What is the IUPAC name of 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide?
The IUPAC name of 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide (CID 55777696) is 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide.
What is the SMILES notation for 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide?
The canonical SMILES for 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide is COc1ccc(Oc2ncccc2NC(=O)CCc2ccc(Cl)s2)cc1.
What is the InChIKey of 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide?
The InChIKey is FPCXIZHZLQLRNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN2O3S/c1-24-13-4-6-14(7-5-13)25-19-16(3-2-12-21-19)22-18(23)11-9-15-8-10-17(20)26-15/h2-8,10,12H,9,11H2,1H3,(H,22,23).
What are the key properties of 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide?
3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide has a molecular weight of 388.88 g/mol, XLogP of 5.17, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-chlorothiophen-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]propanamide is sourced from PubChem (CID 55777696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).