N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide

C19H22N2O3 — CID 17427984

IUPACN-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide
SMILESCOc1ccccc1CCNC(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-24-17-10-6-5-7-15(17)11-13-20-18(22)12-14-21-19(23)16-8-3-2-4-9-16/h2-10H,11-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyTXAJACGUVXCCQH-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.17
Rot. Bonds8

About N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide

N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide (PubChem CID 17427984) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide.

Molecular Properties

Compound NameN-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide
PubChem CID17427984
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC NameN-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide
SMILESCOc1ccccc1CCNC(=O)CCNC(=O)c1ccccc1
InChIInChI=1S/C19H22N2O3/c1-24-17-10-6-5-7-15(17)11-13-20-18(22)12-14-21-19(23)16-8-3-2-4-9-16/h2-10H,11-14H2,1H3,(H,20,22)(H,21,23)
InChIKeyTXAJACGUVXCCQH-UHFFFAOYSA-N
XLogP2.17
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-benzamido-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 55534844
N-[2-(2-methoxyphenyl)ethyl]-4-methylbenzamide
CID 8911194
N-[3-[[N-[2-(2-methoxyphenyl)ethyl]-N'-methylcarbamimidoyl]amino]propyl]benzamide
CID 111340707
N-[2-(2-methoxyphenyl)ethyl]-4-methylpentanamide
CID 78779677
N-[3-[[N-[2-(2-methoxyphenyl)ethyl]-N'-methylcarbamimidoyl]amino]propyl]benzamide;hydroiodide
CID 111340706
N-[6-[(2-methoxyphenyl)methylamino]-6-oxohexyl]benzamide
CID 110838952
3-(benzenesulfonamido)-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 31115017
3-N-benzyl-1-N-[2-(2-methoxyphenyl)ethyl]benzene-1,3-dicarboxamide
CID 109054096
N-[2-(2-methoxyphenyl)ethyl]-3-(2-methylpropylamino)propanamide
CID 109012770
trans-(1S,2S)-N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]-2-methylcyclopropane-1-carboxamide
CID 94164156
3,4-diethoxy-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 31115214
N-[2-(2-methoxyphenyl)ethyl]-2-phenoxyacetamide
CID 8911196

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide?
The IUPAC name of N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide (CID 17427984) is N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide.
What is the SMILES notation for N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide?
The canonical SMILES for N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide is COc1ccccc1CCNC(=O)CCNC(=O)c1ccccc1.
What is the InChIKey of N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide?
The InChIKey is TXAJACGUVXCCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-24-17-10-6-5-7-15(17)11-13-20-18(22)12-14-21-19(23)16-8-3-2-4-9-16/h2-10H,11-14H2,1H3,(H,20,22)(H,21,23).
What are the key properties of N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide?
N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide has a molecular weight of 326.40 g/mol, XLogP of 2.17, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(2-methoxyphenyl)ethylamino]-3-oxopropyl]benzamide is sourced from PubChem (CID 17427984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).