N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide

C16H20N2O3S — CID 67204882

IUPACN-naphthalen-1-yl-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H20N2O3S/c1-3-11-22(20,21)18-12(2)16(19)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,18H,3,11H2,1-2H3,(H,17,19)
InChIKeyHUJFOVKUYJOWFX-UHFFFAOYSA-N
MW320.41 g/mol
LogP2.50
Rot. Bonds6

About N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide

N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide (PubChem CID 67204882) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide.

Molecular Properties

Compound NameN-naphthalen-1-yl-2-(propylsulfonylamino)propanamide
PubChem CID67204882
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC NameN-naphthalen-1-yl-2-(propylsulfonylamino)propanamide
SMILESCCCS(=O)(=O)NC(C)C(=O)Nc1cccc2ccccc12
InChIInChI=1S/C16H20N2O3S/c1-3-11-22(20,21)18-12(2)16(19)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,18H,3,11H2,1-2H3,(H,17,19)
InChIKeyHUJFOVKUYJOWFX-UHFFFAOYSA-N
XLogP2.50
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-naphthalen-1-ylpropanamide
CID 1295084
2-methyl-N-naphthalen-1-ylpentanamide
CID 112762783
(2S)-3-naphthalen-1-yl-2-(propylsulfonylamino)propanoic acid
CID 67206691
6-[2-(propylsulfonylamino)propanoylamino]pyridine-2-carboxylic acid
CID 63642361
(2R)-2-(2-fluoroanilino)-N-naphthalen-1-ylpropanamide
CID 7872612
2-bromo-3-methyl-N-naphthalen-1-ylbutanamide
CID 4074049
(2S)-2-(4-fluoroanilino)-N-naphthalen-1-ylpropanamide
CID 32736092
1-[(2S)-butan-2-yl]-3-naphthalen-1-ylurea
CID 2241028
2-ethyl-N-naphthalen-1-ylhexanamide
CID 3580350
[1-(naphthalen-1-ylamino)-1-oxopropan-2-yl] 2-(benzenesulfonamido)propanoate
CID 55326484
1-naphthalen-1-yl-3-[2-(naphthalen-1-ylcarbamoylamino)phenyl]urea
CID 177491059
1-naphthalen-1-yl-3-[5-(naphthalen-1-ylcarbamoylamino)naphthalen-1-yl]urea
CID 27190755

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide?
The IUPAC name of N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide (CID 67204882) is N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide.
What is the SMILES notation for N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide?
The canonical SMILES for N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide is CCCS(=O)(=O)NC(C)C(=O)Nc1cccc2ccccc12.
What is the InChIKey of N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide?
The InChIKey is HUJFOVKUYJOWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c1-3-11-22(20,21)18-12(2)16(19)17-15-10-6-8-13-7-4-5-9-14(13)15/h4-10,12,18H,3,11H2,1-2H3,(H,17,19).
What are the key properties of N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide?
N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide has a molecular weight of 320.41 g/mol, XLogP of 2.50, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-1-yl-2-(propylsulfonylamino)propanamide is sourced from PubChem (CID 67204882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).