(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide

C25H28N2O3S — CID 24517481

IUPAC(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCC(C)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H28N2O3S/c1-19-14-16-23(17-15-19)31(29,30)27-20(2)24(28)26-18-25(3,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,20,27H,18H2,1-3H3,(H,26,28)/t20-/m0/s1
InChIKeyFEYKDUUMDMNDDU-FQEVSTJZSA-N
MW436.58 g/mol
LogP3.78
Rot. Bonds8

About (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide

(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide (PubChem CID 24517481) has the molecular formula C25H28N2O3S and a molecular weight of 436.58 g/mol. Its IUPAC name is (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
PubChem CID24517481
Molecular FormulaC25H28N2O3S
Molecular Weight436.58 g/mol
Exact Mass436.18
IUPAC Name(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCC(C)(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C25H28N2O3S/c1-19-14-16-23(17-15-19)31(29,30)27-20(2)24(28)26-18-25(3,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,20,27H,18H2,1-3H3,(H,26,28)/t20-/m0/s1
InChIKeyFEYKDUUMDMNDDU-FQEVSTJZSA-N
XLogP3.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.58
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-[(4-methylphenyl)sulfonylamino]-N-[4-[[(2S)-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]butyl]propanamide
CID 23246042
2-[(4-methylphenyl)sulfonylamino]-N-propylpropanamide
CID 5039910
2-[(4-methylphenyl)sulfonylamino]-N-phenylpropanamide
CID 5205930
(2S)-N-benzyl-2-[(4-tert-butylphenyl)sulfonylamino]propanamide
CID 9041047
(2S)-N-tert-butyl-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 40563910
N-(3-hydroxypropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 4545843
(2S)-2-[(4-methylphenyl)sulfonylamino]-N-[[3-[[[(2S)-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]methyl]phenyl]methyl]propanamide
CID 23246044
(2R)-N-hexyl-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 7230015
2-[(4-methylphenyl)sulfonylamino]-N-[2-(trifluoromethyl)phenyl]propanamide
CID 2841182
(2S)-2-[(4-methylphenyl)sulfonylamino]propanoic acid;hydrate
CID 131749441
N-[(4-chlorophenyl)methyl]-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 2947130
(2R)-2-[(4-methylphenyl)sulfonylamino]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 1378166

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The IUPAC name of (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide (CID 24517481) is (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide.
What is the SMILES notation for (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The canonical SMILES for (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide is Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NCC(C)(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The InChIKey is FEYKDUUMDMNDDU-FQEVSTJZSA-N. The full InChI is InChI=1S/C25H28N2O3S/c1-19-14-16-23(17-15-19)31(29,30)27-20(2)24(28)26-18-25(3,21-10-6-4-7-11-21)22-12-8-5-9-13-22/h4-17,20,27H,18H2,1-3H3,(H,26,28)/t20-/m0/s1.
What are the key properties of (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
(2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide has a molecular weight of 436.58 g/mol, XLogP of 3.78, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2,2-diphenylpropyl)-2-[(4-methylphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 24517481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).