N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide

C20H26N2O2 — CID 54812967

IUPACN-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide
SMILESCCC(C)Oc1ccc(NC(=O)CNc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H26N2O2/c1-5-16(4)24-18-10-8-17(9-11-18)22-20(23)13-21-19-12-14(2)6-7-15(19)3/h6-12,16,21H,5,13H2,1-4H3,(H,22,23)
InChIKeySNBZWWLNLHZOSY-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.53
Rot. Bonds7

About N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide

N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide (PubChem CID 54812967) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide.

Molecular Properties

Compound NameN-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide
PubChem CID54812967
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC NameN-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide
SMILESCCC(C)Oc1ccc(NC(=O)CNc2cc(C)ccc2C)cc1
InChIInChI=1S/C20H26N2O2/c1-5-16(4)24-18-10-8-17(9-11-18)22-20(23)13-21-19-12-14(2)6-7-15(19)3/h6-12,16,21H,5,13H2,1-4H3,(H,22,23)
InChIKeySNBZWWLNLHZOSY-UHFFFAOYSA-N
XLogP4.53
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-butan-2-yloxyphenyl)-2-(3-chloro-4-methylanilino)acetamide
CID 54815837
2-anilino-N-(4-butan-2-yloxyphenyl)acetamide
CID 54810187
N-(4-butan-2-yloxyphenyl)-2-(3,4-dimethylphenoxy)acetamide
CID 17160586
2-(4-butan-2-yloxyanilino)-N-(4-butoxyphenyl)acetamide
CID 54830327
4-[[2-(4-butan-2-yloxyanilino)acetyl]amino]-N-propan-2-ylbenzamide
CID 54830400
4-[[2-(4-butan-2-yloxyanilino)-2-oxoethyl]amino]-N-ethylbenzamide
CID 54839201
N-[3-[[2-(4-butan-2-yloxyanilino)-2-oxoethyl]amino]phenyl]-2-methylpropanamide
CID 54831493
N-[3-[[2-(4-butan-2-yloxyanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54830461
4-[[2-(4-butan-2-yloxyanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 54830298
2-(2,5-dimethylanilino)-N-(3-fluoro-4-methylphenyl)acetamide
CID 9079711
N-(4-butan-2-yloxyphenyl)acetamide
CID 17142081
N-[3-[[2-(4-butan-2-yloxyanilino)acetyl]amino]phenyl]butanamide
CID 54830125

Frequently Asked Questions

What is the IUPAC name of N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide?
The IUPAC name of N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide (CID 54812967) is N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide.
What is the SMILES notation for N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide?
The canonical SMILES for N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide is CCC(C)Oc1ccc(NC(=O)CNc2cc(C)ccc2C)cc1.
What is the InChIKey of N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide?
The InChIKey is SNBZWWLNLHZOSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-5-16(4)24-18-10-8-17(9-11-18)22-20(23)13-21-19-12-14(2)6-7-15(19)3/h6-12,16,21H,5,13H2,1-4H3,(H,22,23).
What are the key properties of N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide?
N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide has a molecular weight of 326.44 g/mol, XLogP of 4.53, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-butan-2-yloxyphenyl)-2-(2,5-dimethylanilino)acetamide is sourced from PubChem (CID 54812967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).