N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide

C17H21N3O3S — CID 44591286

IUPACN-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide
SMILESNS(=O)(=O)NCCCCC(=O)Nc1cccc(-c2ccccc2)c1
InChIInChI=1S/C17H21N3O3S/c18-24(22,23)19-12-5-4-11-17(21)20-16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-3,6-10,13,19H,4-5,11-12H2,(H,20,21)(H2,18,22,23)
InChIKeyUYZCEYVRVPQOOM-UHFFFAOYSA-N
MW347.44 g/mol
LogP2.26
Rot. Bonds8

About N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide

N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide (PubChem CID 44591286) has the molecular formula C17H21N3O3S and a molecular weight of 347.44 g/mol. Its IUPAC name is N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide.

Molecular Properties

Compound NameN-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide
PubChem CID44591286
Molecular FormulaC17H21N3O3S
Molecular Weight347.44 g/mol
Exact Mass347.13
IUPAC NameN-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide
SMILESNS(=O)(=O)NCCCCC(=O)Nc1cccc(-c2ccccc2)c1
InChIInChI=1S/C17H21N3O3S/c18-24(22,23)19-12-5-4-11-17(21)20-16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-3,6-10,13,19H,4-5,11-12H2,(H,20,21)(H2,18,22,23)
InChIKeyUYZCEYVRVPQOOM-UHFFFAOYSA-N
XLogP2.26
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 52.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[[2-(2-amino-2-oxoethyl)sulfanylacetyl]amino]-N-(3-phenylphenyl)hexanamide
CID 69386598
2-[2-oxo-2-[[6-oxo-6-(3-phenylanilino)hexyl]amino]ethyl]sulfinylacetic acid
CID 11952973
6-[[2-(4-aminophenyl)sulfanylacetyl]amino]-N-(3-phenylphenyl)hexanamide
CID 69384583
CID 58756744
CID 58756744
5-(tert-butylsulfonylamino)-N-phenylpentanamide
CID 20631022
5-bromo-N-[3-(sulfamoylamino)phenyl]pentanamide
CID 107908922
N-(3-acetamidophenyl)-5-(tert-butylsulfonylamino)pentanamide
CID 20629712
6-[[2-[[4-(hydroxymethyl)phenyl]methoxy]acetyl]amino]-N-(3-phenylphenyl)hexanamide
CID 11952976
N,N'-bis[3-[(2-phenylacetyl)amino]phenyl]nonanediamide
CID 17235933
(11-sulfosulfanylundecanoylamino)benzene
CID 134881745
(3-phenylphenyl)carbamic acid
CID 611602
4-[(4-fluorophenyl)sulfonylamino]-N-[3-(sulfamoylamino)phenyl]butanamide
CID 55558986

Frequently Asked Questions

What is the IUPAC name of N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide?
The IUPAC name of N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide (CID 44591286) is N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide.
What is the SMILES notation for N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide?
The canonical SMILES for N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide is NS(=O)(=O)NCCCCC(=O)Nc1cccc(-c2ccccc2)c1.
What is the InChIKey of N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide?
The InChIKey is UYZCEYVRVPQOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3S/c18-24(22,23)19-12-5-4-11-17(21)20-16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-3,6-10,13,19H,4-5,11-12H2,(H,20,21)(H2,18,22,23).
What are the key properties of N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide?
N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide has a molecular weight of 347.44 g/mol, XLogP of 2.26, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenylphenyl)-5-(sulfamoylamino)pentanamide is sourced from PubChem (CID 44591286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).