2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide

C19H24N2O2 — CID 112987415

IUPAC2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O2/c1-4-14(5-2)19(22)21-16-11-9-15(10-12-16)20-17-7-6-8-18(13-17)23-3/h6-14,20H,4-5H2,1-3H3,(H,21,22)
InChIKeyDCQIZZVTBHEMQE-UHFFFAOYSA-N
MW312.41 g/mol
LogP4.81
Rot. Bonds7

About 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide

2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide (PubChem CID 112987415) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide.

Molecular Properties

Compound Name2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide
PubChem CID112987415
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC Name2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide
SMILESCCC(CC)C(=O)Nc1ccc(Nc2cccc(OC)c2)cc1
InChIInChI=1S/C19H24N2O2/c1-4-14(5-2)19(22)21-16-11-9-15(10-12-16)20-17-7-6-8-18(13-17)23-3/h6-14,20H,4-5H2,1-3H3,(H,21,22)
InChIKeyDCQIZZVTBHEMQE-UHFFFAOYSA-N
XLogP4.81
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-bromo-N-(3-methoxyphenyl)butanamide
CID 50742538
N-[4-(3-methoxyanilino)phenyl]-2-(2-methylphenyl)acetamide
CID 112987456
N-[4-(3-methoxyanilino)phenyl]-3-phenoxypropanamide
CID 112987443
N-(3-methoxyphenyl)-2-phenoxybutanamide
CID 3831473
2-ethyl-N-[4-[4-(2-ethylbutanoylamino)phenoxy]phenyl]butanamide
CID 1000871
2,2-dichloro-N-(3-methoxyphenyl)acetamide
CID 5097021
2-hydroxy-N-(3-methoxyphenyl)propanamide
CID 82125804
methyl 3-(2-ethylbutanoylamino)benzoate
CID 43404089
3-fluoro-N-[4-(3-methoxyanilino)phenyl]benzamide
CID 112987423
(2S)-2-chloro-N-(3-methoxyphenyl)propanamide
CID 6591303
1-(3-methoxyphenyl)-3-(4-methoxyphenyl)urea
CID 872322
2-ethyl-N-[3-(2-methylpropanoylamino)phenyl]butanamide
CID 21430939

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide?
The IUPAC name of 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide (CID 112987415) is 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide.
What is the SMILES notation for 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide?
The canonical SMILES for 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide is CCC(CC)C(=O)Nc1ccc(Nc2cccc(OC)c2)cc1.
What is the InChIKey of 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide?
The InChIKey is DCQIZZVTBHEMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-4-14(5-2)19(22)21-16-11-9-15(10-12-16)20-17-7-6-8-18(13-17)23-3/h6-14,20H,4-5H2,1-3H3,(H,21,22).
What are the key properties of 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide?
2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide has a molecular weight of 312.41 g/mol, XLogP of 4.81, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-[4-(3-methoxyanilino)phenyl]butanamide is sourced from PubChem (CID 112987415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).