2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide

C14H15N3O3S — CID 62113291

IUPAC2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide
SMILESCC(C(=O)Nc1ccccc1)S(=O)(=O)c1ccncc1N
InChIInChI=1S/C14H15N3O3S/c1-10(14(18)17-11-5-3-2-4-6-11)21(19,20)13-7-8-16-9-12(13)15/h2-10H,15H2,1H3,(H,17,18)
InChIKeyZTDVWTHFIBHHGA-UHFFFAOYSA-N
MW305.36 g/mol
LogP1.46
Rot. Bonds4

About 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide

2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide (PubChem CID 62113291) has the molecular formula C14H15N3O3S and a molecular weight of 305.36 g/mol. Its IUPAC name is 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide.

Molecular Properties

Compound Name2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide
PubChem CID62113291
Molecular FormulaC14H15N3O3S
Molecular Weight305.36 g/mol
Exact Mass305.08
IUPAC Name2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide
SMILESCC(C(=O)Nc1ccccc1)S(=O)(=O)c1ccncc1N
InChIInChI=1S/C14H15N3O3S/c1-10(14(18)17-11-5-3-2-4-6-11)21(19,20)13-7-8-16-9-12(13)15/h2-10H,15H2,1H3,(H,17,18)
InChIKeyZTDVWTHFIBHHGA-UHFFFAOYSA-N
XLogP1.46
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.36
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(3-amino-4-pyridinyl)sulfonyl]-1-pyrrolidin-1-ylpropan-1-one
CID 62113460
1-(3-amino-4-pyridinyl)-3-phenylurea
CID 63061923
2-(1-anilino-1-oxopropan-2-yl)sulfonylpropanoic acid
CID 43117074
(2S)-2-(2,2-dimethylpropylsulfonyl)-N-phenylpropanamide
CID 125141054
2-(3-aminopropylsulfonyl)-N-phenylpropanamide
CID 79015099
2-(benzenesulfonyl)-N-(4-sulfamoylphenyl)propanamide
CID 164613992
N-(3-amino-4-pyridinyl)-2-phenylpropanamide
CID 114028695
(2S)-2-benzylsulfonyl-N-phenylpropanamide
CID 51983101
(2R)-2-amino-N-phenylpropanamide
CID 10607114
2-(2-hydroxyethylsulfonyl)-N-phenylpropanamide
CID 82181671
2-(2-amino-4-fluorophenyl)sulfonyl-N-methylpropanamide
CID 81184526
2-(2-amino-4-bromophenyl)sulfonyl-N-methylpropanamide
CID 81185562

Frequently Asked Questions

What is the IUPAC name of 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide?
The IUPAC name of 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide (CID 62113291) is 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide.
What is the SMILES notation for 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide?
The canonical SMILES for 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide is CC(C(=O)Nc1ccccc1)S(=O)(=O)c1ccncc1N.
What is the InChIKey of 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide?
The InChIKey is ZTDVWTHFIBHHGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O3S/c1-10(14(18)17-11-5-3-2-4-6-11)21(19,20)13-7-8-16-9-12(13)15/h2-10H,15H2,1H3,(H,17,18).
What are the key properties of 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide?
2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide has a molecular weight of 305.36 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-amino-4-pyridinyl)sulfonyl]-N-phenylpropanamide is sourced from PubChem (CID 62113291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).