N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide

C15H23N3O2 — CID 17414098

IUPACN-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide
SMILESCCC(C)(C)NCC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H23N3O2/c1-5-15(3,4)16-10-14(20)18-13-8-6-12(7-9-13)17-11(2)19/h6-9,16H,5,10H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyWFLPZYFKRAYTMT-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.36
Rot. Bonds6

About N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide

N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide (PubChem CID 17414098) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide
PubChem CID17414098
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide
SMILESCCC(C)(C)NCC(=O)Nc1ccc(NC(C)=O)cc1
InChIInChI=1S/C15H23N3O2/c1-5-15(3,4)16-10-14(20)18-13-8-6-12(7-9-13)17-11(2)19/h6-9,16H,5,10H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyWFLPZYFKRAYTMT-UHFFFAOYSA-N
XLogP2.36
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(4-acetylanilino)-2-oxoethyl]amino]-2-methylbutanoic acid
CID 79790725
2-(3-ethylpentan-3-ylamino)-N-(4-methylphenyl)acetamide
CID 65039600
N-[4-[[2-(4-acetamidoanilino)acetyl]amino]phenyl]butanamide
CID 54809172
2-(tert-butylamino)-N-(4-ethylsulfonylphenyl)acetamide
CID 78923640
2-[[2-(3,4-dichloroanilino)-2-oxoethyl]amino]-2-methylbutanoic acid
CID 79801945
N-(4-acetamidophenyl)-2-(4-chloroanilino)acetamide
CID 2604426
N-(4-fluorophenyl)-2-[(1-methoxy-2-methylpropan-2-yl)amino]acetamide
CID 113276454
2-(4-acetamidoanilino)-N-(4-ethoxyphenyl)acetamide
CID 54808313
N'-(4-acetamidophenyl)-N-(4-acetylphenyl)propanediamide
CID 108956176
2-(4-acetamidoanilino)-N-tert-butylacetamide
CID 28567256
N-(4-acetamidophenyl)-2-(2-hydroxyethylamino)acetamide
CID 82358506
4-[[2-(4-acetamidoanilino)-2-oxoethyl]amino]-N-tert-butylbenzamide
CID 54835003

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide?
The IUPAC name of N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide (CID 17414098) is N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide?
The canonical SMILES for N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide is CCC(C)(C)NCC(=O)Nc1ccc(NC(C)=O)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide?
The InChIKey is WFLPZYFKRAYTMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-5-15(3,4)16-10-14(20)18-13-8-6-12(7-9-13)17-11(2)19/h6-9,16H,5,10H2,1-4H3,(H,17,19)(H,18,20).
What are the key properties of N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide?
N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide has a molecular weight of 277.37 g/mol, XLogP of 2.36, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2-(2-methylbutan-2-ylamino)acetamide is sourced from PubChem (CID 17414098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).