N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide

C23H24N2O3 — CID 109001103

IUPACN-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide
SMILESCOc1cccc(CCNC(=O)CNc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O3/c1-27-22-9-5-6-18(16-22)14-15-24-23(26)17-25-19-10-12-21(13-11-19)28-20-7-3-2-4-8-20/h2-13,16,25H,14-15,17H2,1H3,(H,24,26)
InChIKeyJWCCPVQQYOQPNF-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.26
Rot. Bonds9

About N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide

N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide (PubChem CID 109001103) has the molecular formula C23H24N2O3 and a molecular weight of 376.46 g/mol. Its IUPAC name is N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide.

Molecular Properties

Compound NameN-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide
PubChem CID109001103
Molecular FormulaC23H24N2O3
Molecular Weight376.46 g/mol
Exact Mass376.18
IUPAC NameN-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide
SMILESCOc1cccc(CCNC(=O)CNc2ccc(Oc3ccccc3)cc2)c1
InChIInChI=1S/C23H24N2O3/c1-27-22-9-5-6-18(16-22)14-15-24-23(26)17-25-19-10-12-21(13-11-19)28-20-7-3-2-4-8-20/h2-13,16,25H,14-15,17H2,1H3,(H,24,26)
InChIKeyJWCCPVQQYOQPNF-UHFFFAOYSA-N
XLogP4.26
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 109001073
methyl N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]carbamate
CID 47308059
2-(3-cyanoanilino)-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 109001133
2-hydroxy-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 94681482
2-amino-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22690352
4-[2-(3-methoxyphenyl)ethylamino]-4-oxobutanoic acid;hydrochloride
CID 170649983
phenyl N-[2-(3-methoxyphenyl)ethyl]carbamate
CID 110755565
5-[2-(3-methoxyphenyl)ethylamino]-3,3-dimethyl-5-oxopentanoic acid
CID 106703116
2-(4-bromoanilino)-N-[(3-methoxyphenyl)methyl]acetamide
CID 31525110
N-[2-(3-methoxyphenyl)ethyl]-2-(2-methylpropylamino)acetamide
CID 108993195
N-[2-(3-methoxyphenyl)ethyl]-2-(3-phenylmethoxyphenyl)acetamide
CID 13406973
1-[[2-(4-methoxyanilino)acetyl]amino]-3-(2-phenylethyl)thiourea
CID 8617393

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide?
The IUPAC name of N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide (CID 109001103) is N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide.
What is the SMILES notation for N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide?
The canonical SMILES for N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide is COc1cccc(CCNC(=O)CNc2ccc(Oc3ccccc3)cc2)c1.
What is the InChIKey of N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide?
The InChIKey is JWCCPVQQYOQPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O3/c1-27-22-9-5-6-18(16-22)14-15-24-23(26)17-25-19-10-12-21(13-11-19)28-20-7-3-2-4-8-20/h2-13,16,25H,14-15,17H2,1H3,(H,24,26).
What are the key properties of N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide?
N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide has a molecular weight of 376.46 g/mol, XLogP of 4.26, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methoxyphenyl)ethyl]-2-(4-phenoxyanilino)acetamide is sourced from PubChem (CID 109001103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).