2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide

C18H22N2O3 — CID 109001073

IUPAC2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)CNc2cccc(OC)c2)c1
InChIInChI=1S/C18H22N2O3/c1-22-16-7-3-5-14(11-16)9-10-19-18(21)13-20-15-6-4-8-17(12-15)23-2/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,19,21)
InChIKeyGJPLAGXNHCEQKD-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.47
Rot. Bonds8

About 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide

2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide (PubChem CID 109001073) has the molecular formula C18H22N2O3 and a molecular weight of 314.39 g/mol. Its IUPAC name is 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
PubChem CID109001073
Molecular FormulaC18H22N2O3
Molecular Weight314.39 g/mol
Exact Mass314.16
IUPAC Name2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
SMILESCOc1cccc(CCNC(=O)CNc2cccc(OC)c2)c1
InChIInChI=1S/C18H22N2O3/c1-22-16-7-3-5-14(11-16)9-10-19-18(21)13-20-15-6-4-8-17(12-15)23-2/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,19,21)
InChIKeyGJPLAGXNHCEQKD-UHFFFAOYSA-N
XLogP2.47
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-cyanoanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 109001133
N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide
CID 109001103
2-(3-methoxyanilino)-N-(2-methoxyethyl)acetamide
CID 39335252
methyl N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]carbamate
CID 47308059
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide
CID 108993195
2-(2-bromo-4-methylanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 109001108
N-[2-(4-fluorophenyl)ethyl]-3-(3-methoxyanilino)propanamide
CID 109025014
N-[2-(4-chlorophenyl)ethyl]-2-[2-(3-methoxyphenyl)ethylamino]acetamide
CID 109000854
N-[2-(3-methoxyphenyl)ethyl]-2-oxopropanamide
CID 110478240
2-(3-methoxyanilino)-N-(2,2,2-trifluoroethyl)acetamide
CID 60646925

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide (CID 109001073) is 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide is COc1cccc(CCNC(=O)CNc2cccc(OC)c2)c1.
What is the InChIKey of 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
The InChIKey is GJPLAGXNHCEQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3/c1-22-16-7-3-5-14(11-16)9-10-19-18(21)13-20-15-6-4-8-17(12-15)23-2/h3-8,11-12,20H,9-10,13H2,1-2H3,(H,19,21).
What are the key properties of 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide?
2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide has a molecular weight of 314.39 g/mol, XLogP of 2.47, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 109001073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).