N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide

C23H30N2O2 — CID 113059053

IUPACN-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNC(=O)Cc1ccccc1C)c1ccccc1C(C)(C)C
InChIInChI=1S/C23H30N2O2/c1-17-10-6-7-11-19(17)16-22(27)24-14-15-25(18(2)26)21-13-9-8-12-20(21)23(3,4)5/h6-13H,14-16H2,1-5H3,(H,24,27)
InChIKeyYKSQPGDVTFSOCL-UHFFFAOYSA-N
MW366.51 g/mol
LogP4.00
Rot. Bonds6

About N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide

N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide (PubChem CID 113059053) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide
PubChem CID113059053
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide
SMILESCC(=O)N(CCNC(=O)Cc1ccccc1C)c1ccccc1C(C)(C)C
InChIInChI=1S/C23H30N2O2/c1-17-10-6-7-11-19(17)16-22(27)24-14-15-25(18(2)26)21-13-9-8-12-20(21)23(3,4)5/h6-13H,14-16H2,1-5H3,(H,24,27)
InChIKeyYKSQPGDVTFSOCL-UHFFFAOYSA-N
XLogP4.00
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(N-acetyl-2,6-diethylanilino)ethyl]-2-(2-methylphenyl)acetamide
CID 113058904
N-[2-[N-acetyl-2-(trifluoromethyl)anilino]ethyl]-2-methylbenzamide
CID 113061372
N-[2-[N-acetyl-2,6-di(propan-2-yl)anilino]ethyl]-2-(2-methylphenyl)acetamide
CID 113063126
N-[2-(N-acetyl-4-chloro-2-methoxy-5-methylanilino)ethyl]-2-(2-methylphenyl)acetamide
CID 113063961
N-[2-(N-acetyl-2-ethylanilino)ethyl]-2-phenylacetamide
CID 113058316
3-(N-acetyl-2-tert-butylanilino)-N-(2,3-dimethylphenyl)propanamide
CID 113126445
N-[2-(N-acetyl-2-methylanilino)ethyl]-2-(3-fluorophenyl)acetamide
CID 113057339
N-[2-(2-tert-butylanilino)-2-oxoethyl]-2-(2-methylphenyl)acetamide
CID 112997518
N-[2-(N-acetyl-2-tert-butylanilino)ethyl]oxolane-2-carboxamide
CID 113059012
N-[2-[acetyl(cyclohexyl)amino]ethyl]-2-(2-methylphenyl)acetamide
CID 113052961
N-[2-(N-acetyl-4-methylanilino)ethyl]-2-(2-bromophenyl)acetamide
CID 113057598
N-[2-(N-acetyl-2-ethylanilino)ethyl]thiophene-2-carboxamide
CID 113058294

Frequently Asked Questions

What is the IUPAC name of N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide (CID 113059053) is N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide is CC(=O)N(CCNC(=O)Cc1ccccc1C)c1ccccc1C(C)(C)C.
What is the InChIKey of N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide?
The InChIKey is YKSQPGDVTFSOCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-17-10-6-7-11-19(17)16-22(27)24-14-15-25(18(2)26)21-13-9-8-12-20(21)23(3,4)5/h6-13H,14-16H2,1-5H3,(H,24,27).
What are the key properties of N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide?
N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide has a molecular weight of 366.51 g/mol, XLogP of 4.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(N-acetyl-2-tert-butylanilino)ethyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 113059053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).