N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide

C23H24N2O2S — CID 46432041

IUPACN-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
SMILESCC(NC(=O)CCNC(=O)c1ccsc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N2O2S/c1-17(25-21(26)12-14-24-23(27)20-13-15-28-16-20)22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,13,15-17,22H,12,14H2,1H3,(H,24,27)(H,25,26)
InChIKeyOJWLVCNBIFPJIM-UHFFFAOYSA-N
MW392.52 g/mol
LogP4.20
Rot. Bonds8

About N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide

N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide (PubChem CID 46432041) has the molecular formula C23H24N2O2S and a molecular weight of 392.52 g/mol. Its IUPAC name is N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
PubChem CID46432041
Molecular FormulaC23H24N2O2S
Molecular Weight392.52 g/mol
Exact Mass392.16
IUPAC NameN-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
SMILESCC(NC(=O)CCNC(=O)c1ccsc1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C23H24N2O2S/c1-17(25-21(26)12-14-24-23(27)20-13-15-28-16-20)22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,13,15-17,22H,12,14H2,1H3,(H,24,27)(H,25,26)
InChIKeyOJWLVCNBIFPJIM-UHFFFAOYSA-N
XLogP4.20
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.52
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(3-methylbutan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 43043343
N-[3-(5-methylhexan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide
CID 78803837
N-[4-oxo-4-[1-(4-phenylphenyl)ethylamino]butyl]thiophene-3-carboxamide
CID 24683991
N-[3-[1-(4-ethoxyphenyl)ethylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 134010279
N-[3-[1-(3-chlorophenyl)propylamino]-3-oxopropyl]thiophene-3-carboxamide
CID 55582086
methyl 3-phenyl-3-[4-(thiophene-3-carbonylamino)butanoylamino]propanoate
CID 18121213
N-[4-(1-hydroxypropan-2-ylamino)-4-oxobutyl]thiophene-3-carboxamide
CID 110887400
N-[3-oxo-3-(4-phenylanilino)propyl]thiophene-3-carboxamide
CID 46580901
4-methyl-2-[[3-(thiophene-3-carbonylamino)propanoylamino]methyl]pentanoic acid
CID 119252831
2-methyl-2-[3-(thiophene-3-carbonylamino)propanoylamino]propanoic acid
CID 61263000
N-[2-(thiophene-3-carbonylamino)ethyl]thiophene-3-carboxamide
CID 101004058
N-[4-[[(1S)-1-(2-methoxyphenyl)ethyl]amino]-4-oxobutyl]thiophene-3-carboxamide
CID 39958882

Frequently Asked Questions

What is the IUPAC name of N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide?
The IUPAC name of N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide (CID 46432041) is N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide?
The canonical SMILES for N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide is CC(NC(=O)CCNC(=O)c1ccsc1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide?
The InChIKey is OJWLVCNBIFPJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O2S/c1-17(25-21(26)12-14-24-23(27)20-13-15-28-16-20)22(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,13,15-17,22H,12,14H2,1H3,(H,24,27)(H,25,26).
What are the key properties of N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide?
N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide has a molecular weight of 392.52 g/mol, XLogP of 4.20, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(1,1-diphenylpropan-2-ylamino)-3-oxopropyl]thiophene-3-carboxamide is sourced from PubChem (CID 46432041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).