2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide

C20H24N2O3 — CID 2996779

IUPAC2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide
SMILESCNC(=O)COc1ccccc1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(12-13-16-8-4-3-5-9-16)22-20(24)17-10-6-7-11-18(17)25-14-19(23)21-2/h3-11,15H,12-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyOTTDKYLZUXILBZ-UHFFFAOYSA-N
MW340.42 g/mol
LogP2.56
Rot. Bonds8

About 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide

2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide (PubChem CID 2996779) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide.

Molecular Properties

Compound Name2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide
PubChem CID2996779
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide
SMILESCNC(=O)COc1ccccc1C(=O)NC(C)CCc1ccccc1
InChIInChI=1S/C20H24N2O3/c1-15(12-13-16-8-4-3-5-9-16)22-20(24)17-10-6-7-11-18(17)25-14-19(23)21-2/h3-11,15H,12-14H2,1-2H3,(H,21,23)(H,22,24)
InChIKeyOTTDKYLZUXILBZ-UHFFFAOYSA-N
XLogP2.56
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-bromophenoxy)-N-(4-phenylbutan-2-yl)acetamide
CID 4781197
2-(2-benzylphenoxy)-N-methylacetamide
CID 7661700
2-(2-acetyl-4-chlorophenoxy)-N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 7167774
5-bromo-2-ethoxy-N-(4-phenylbutan-2-yl)benzamide
CID 2947744
2-[2-(methylamino)-2-oxoethoxy]benzamide
CID 2578374
2-ethoxy-N-[(2R)-pentan-2-yl]benzamide
CID 1234495
2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide
CID 9018570
2-[(2-phenoxyacetyl)amino]-N-[(2S)-4-phenylbutan-2-yl]acetamide
CID 2128560
(2R)-2-[[2-(2-carbamoylphenoxy)acetyl]amino]propanoic acid
CID 54991568
3-methoxy-N-[(2S)-4-phenylbutan-2-yl]naphthalene-2-carboxamide
CID 26290914
2-(4-bromo-2-formylphenoxy)-N-[(2R)-4-phenylbutan-2-yl]acetamide
CID 7820162
2-[2-(methylcarbamoyl)phenoxy]acetic acid
CID 3026256

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide?
The IUPAC name of 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide (CID 2996779) is 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide.
What is the SMILES notation for 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide?
The canonical SMILES for 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide is CNC(=O)COc1ccccc1C(=O)NC(C)CCc1ccccc1.
What is the InChIKey of 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide?
The InChIKey is OTTDKYLZUXILBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15(12-13-16-8-4-3-5-9-16)22-20(24)17-10-6-7-11-18(17)25-14-19(23)21-2/h3-11,15H,12-14H2,1-2H3,(H,21,23)(H,22,24).
What are the key properties of 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide?
2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide has a molecular weight of 340.42 g/mol, XLogP of 2.56, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)-2-oxoethoxy]-N-(4-phenylbutan-2-yl)benzamide is sourced from PubChem (CID 2996779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).