N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide

C25H30N2O3S — CID 43896244

IUPACN-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
SMILESCC(CC(C)(C)c1ccccc1)NC(=O)CN(c1cccc2ccccc12)S(C)(=O)=O
InChIInChI=1S/C25H30N2O3S/c1-19(17-25(2,3)21-13-6-5-7-14-21)26-24(28)18-27(31(4,29)30)23-16-10-12-20-11-8-9-15-22(20)23/h5-16,19H,17-18H2,1-4H3,(H,26,28)
InChIKeyUEPDAARJZKZNHX-UHFFFAOYSA-N
MW438.59 g/mol
LogP4.48
Rot. Bonds8

About N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide

N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide (PubChem CID 43896244) has the molecular formula C25H30N2O3S and a molecular weight of 438.59 g/mol. Its IUPAC name is N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide.

Molecular Properties

Compound NameN-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
PubChem CID43896244
Molecular FormulaC25H30N2O3S
Molecular Weight438.59 g/mol
Exact Mass438.20
IUPAC NameN-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
SMILESCC(CC(C)(C)c1ccccc1)NC(=O)CN(c1cccc2ccccc12)S(C)(=O)=O
InChIInChI=1S/C25H30N2O3S/c1-19(17-25(2,3)21-13-6-5-7-14-21)26-24(28)18-27(31(4,29)30)23-16-10-12-20-11-8-9-15-22(20)23/h5-16,19H,17-18H2,1-4H3,(H,26,28)
InChIKeyUEPDAARJZKZNHX-UHFFFAOYSA-N
XLogP4.48
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.59
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dimethyl-N-methylsulfonylanilino)-N-(4-methyl-4-phenylpentan-2-yl)acetamide
CID 43895242
N-(4-methyl-4-phenylpentan-2-yl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 43901431
2-(2,5-dimethoxy-N-methylsulfonylanilino)-N-(4-methyl-4-phenylpentan-2-yl)acetamide
CID 43895699
N-(2-hydrazinyl-2-oxoethyl)-N-naphthalen-1-ylmethanesulfonamide
CID 50895807
N-[1-(4-fluorophenyl)ethyl]-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 43904526
2-[methylsulfonyl(naphthalen-1-yl)amino]-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide
CID 43896263
N-[1-(4-methylphenoxy)propan-2-yl]-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 43896242
N-[(R)-(2-methylphenyl)-phenylmethyl]-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 99957493
4-(4-methoxy-N-methylsulfonylanilino)-N-(4-methyl-4-phenylpentan-2-yl)butanamide
CID 133202217
N-(1-methylpiperidin-4-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 50945576
N-butyl-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 126130247
2-(3-chloro-N-(4-methylphenyl)sulfonylanilino)-N-(4-methyl-4-phenylpentan-2-yl)acetamide
CID 43894010

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide?
The IUPAC name of N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide (CID 43896244) is N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide.
What is the SMILES notation for N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide?
The canonical SMILES for N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide is CC(CC(C)(C)c1ccccc1)NC(=O)CN(c1cccc2ccccc12)S(C)(=O)=O.
What is the InChIKey of N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide?
The InChIKey is UEPDAARJZKZNHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N2O3S/c1-19(17-25(2,3)21-13-6-5-7-14-21)26-24(28)18-27(31(4,29)30)23-16-10-12-20-11-8-9-15-22(20)23/h5-16,19H,17-18H2,1-4H3,(H,26,28).
What are the key properties of N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide?
N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide has a molecular weight of 438.59 g/mol, XLogP of 4.48, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-4-phenylpentan-2-yl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide is sourced from PubChem (CID 43896244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).