N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide

C18H21N3O4S — CID 9204402

IUPACN-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C18H21N3O4S/c22-18(7-6-15-3-2-8-19-14-15)20-16-4-1-5-17(13-16)26(23,24)21-9-11-25-12-10-21/h1-5,8,13-14H,6-7,9-12H2,(H,20,22)
InChIKeyPRVHZUVPIBWXEU-UHFFFAOYSA-N
MW375.45 g/mol
LogP1.67
Rot. Bonds6

About N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide

N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide (PubChem CID 9204402) has the molecular formula C18H21N3O4S and a molecular weight of 375.45 g/mol. Its IUPAC name is N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide
PubChem CID9204402
Molecular FormulaC18H21N3O4S
Molecular Weight375.45 g/mol
Exact Mass375.13
IUPAC NameN-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide
SMILESO=C(CCc1cccnc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1
InChIInChI=1S/C18H21N3O4S/c22-18(7-6-15-3-2-8-19-14-15)20-16-4-1-5-17(13-16)26(23,24)21-9-11-25-12-10-21/h1-5,8,13-14H,6-7,9-12H2,(H,20,22)
InChIKeyPRVHZUVPIBWXEU-UHFFFAOYSA-N
XLogP1.67
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.45
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-tert-butylphenyl)-N-(3-morpholin-4-ylsulfonylphenyl)propanamide
CID 29203618
N-(3-morpholin-4-ylsulfonylphenyl)-4-pyridin-3-ylsulfonylpiperazine-1-carboxamide
CID 55697164
N-(4-morpholin-4-ylphenyl)-3-pyridin-3-ylpropanamide
CID 35147983
N-(3-morpholin-4-ylsulfonylphenyl)-2-(2-pyridin-3-yl-1,3-thiazol-4-yl)acetamide
CID 55386608
7-amino-N-(3-morpholin-4-ylsulfonylphenyl)heptanamide
CID 119671799
N-(4-morpholin-4-ylsulfonylphenyl)-3-phenylpropanamide
CID 1164401
N-(3-morpholin-4-ylsulfonylphenyl)-2-pyridin-2-ylsulfanylacetamide
CID 16530319
2-(4-aminophenyl)-N-(3-morpholin-4-ylsulfonylphenyl)acetamide;hydrochloride
CID 119671802
N-[3-(3-morpholin-4-ylsulfonylanilino)-3-oxopropyl]benzamide
CID 8874279
3-(4-morpholin-4-ylsulfonylphenyl)-N-(3-propoxyphenyl)propanamide
CID 55655217
3-(4-fluorophenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 30684734
3-(4-chlorophenyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 24554825

Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide?
The IUPAC name of N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide (CID 9204402) is N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide is O=C(CCc1cccnc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1.
What is the InChIKey of N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide?
The InChIKey is PRVHZUVPIBWXEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4S/c22-18(7-6-15-3-2-8-19-14-15)20-16-4-1-5-17(13-16)26(23,24)21-9-11-25-12-10-21/h1-5,8,13-14H,6-7,9-12H2,(H,20,22).
What are the key properties of N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide?
N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide has a molecular weight of 375.45 g/mol, XLogP of 1.67, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylsulfonylphenyl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 9204402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).