2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide

C23H26N2O3S — CID 42703154

IUPAC2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide
SMILESCCCC(NS(=O)(=O)c1cccc2ccccc12)C(=O)NC(C)c1ccccc1
InChIInChI=1S/C23H26N2O3S/c1-3-10-21(23(26)24-17(2)18-11-5-4-6-12-18)25-29(27,28)22-16-9-14-19-13-7-8-15-20(19)22/h4-9,11-17,21,25H,3,10H2,1-2H3,(H,24,26)
InChIKeySCTONZTZVYMVMC-UHFFFAOYSA-N
MW410.54 g/mol
LogP4.16
Rot. Bonds8

About 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide

2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide (PubChem CID 42703154) has the molecular formula C23H26N2O3S and a molecular weight of 410.54 g/mol. Its IUPAC name is 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide.

Molecular Properties

Compound Name2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide
PubChem CID42703154
Molecular FormulaC23H26N2O3S
Molecular Weight410.54 g/mol
Exact Mass410.17
IUPAC Name2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide
SMILESCCCC(NS(=O)(=O)c1cccc2ccccc12)C(=O)NC(C)c1ccccc1
InChIInChI=1S/C23H26N2O3S/c1-3-10-21(23(26)24-17(2)18-11-5-4-6-12-18)25-29(27,28)22-16-9-14-19-13-7-8-15-20(19)22/h4-9,11-17,21,25H,3,10H2,1-2H3,(H,24,26)
InChIKeySCTONZTZVYMVMC-UHFFFAOYSA-N
XLogP4.16
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.54
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-morpholin-4-yl-2-(naphthalen-1-ylsulfonylamino)pentanamide
CID 155168527
2-(naphthalen-1-ylsulfonylamino)octanoic acid
CID 102208300
2-methyl-3-(naphthalen-1-ylsulfonylamino)butanoic acid
CID 114795460
(2R)-2-(naphthalen-1-ylsulfonylamino)propanoic acid
CID 103862696
1-N,5-N-bis[(1S)-1-phenylethyl]naphthalene-1,5-disulfonamide
CID 1274088
(2R)-2-(isoquinolin-5-ylsulfonylamino)pentanoic acid
CID 104935427
methyl 2-(naphthalen-1-ylsulfonylamino)-2-phenylacetate
CID 3820681
N-[(2S)-3-oxo-1-phenylbutan-2-yl]naphthalene-1-sulfonamide
CID 35399383
(2R)-2-(phenylcarbamoylamino)-N-[(1S)-1-phenylethyl]pentanamide
CID 7218963
N-(3-ethylpentan-2-yl)naphthalene-1-sulfonamide
CID 114795805
(2S)-2-(naphthalen-1-ylsulfonylamino)-3-phenylpropanoic acid
CID 22216410
N-[1-(4-chlorophenyl)ethyl]naphthalene-1-sulfonamide
CID 3415984

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide?
The IUPAC name of 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide (CID 42703154) is 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide.
What is the SMILES notation for 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide?
The canonical SMILES for 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide is CCCC(NS(=O)(=O)c1cccc2ccccc12)C(=O)NC(C)c1ccccc1.
What is the InChIKey of 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide?
The InChIKey is SCTONZTZVYMVMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O3S/c1-3-10-21(23(26)24-17(2)18-11-5-4-6-12-18)25-29(27,28)22-16-9-14-19-13-7-8-15-20(19)22/h4-9,11-17,21,25H,3,10H2,1-2H3,(H,24,26).
What are the key properties of 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide?
2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide has a molecular weight of 410.54 g/mol, XLogP of 4.16, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylsulfonylamino)-N-(1-phenylethyl)pentanamide is sourced from PubChem (CID 42703154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).