2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide

C22H28N2O3 — CID 9018570

IUPAC2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide
SMILESCC(C)CC[C@@H](C)NC(=O)COc1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C22H28N2O3/c1-16(2)13-14-17(3)23-21(25)15-27-20-12-8-7-11-19(20)22(26)24-18-9-5-4-6-10-18/h4-12,16-17H,13-15H2,1-3H3,(H,23,25)(H,24,26)/t17-/m1/s1
InChIKeyRCFWGLRVKXWXTN-QGZVFWFLSA-N
MW368.48 g/mol
LogP4.26
Rot. Bonds9

About 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide

2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide (PubChem CID 9018570) has the molecular formula C22H28N2O3 and a molecular weight of 368.48 g/mol. Its IUPAC name is 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide.

Molecular Properties

Compound Name2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide
PubChem CID9018570
Molecular FormulaC22H28N2O3
Molecular Weight368.48 g/mol
Exact Mass368.21
IUPAC Name2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide
SMILESCC(C)CC[C@@H](C)NC(=O)COc1ccccc1C(=O)Nc1ccccc1
InChIInChI=1S/C22H28N2O3/c1-16(2)13-14-17(3)23-21(25)15-27-20-12-8-7-11-19(20)22(26)24-18-9-5-4-6-10-18/h4-12,16-17H,13-15H2,1-3H3,(H,23,25)(H,24,26)/t17-/m1/s1
InChIKeyRCFWGLRVKXWXTN-QGZVFWFLSA-N
XLogP4.26
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.48
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2R)-4-methyl-2-[[2-[2-(phenylcarbamoyl)phenoxy]acetyl]amino]pentanoate
CID 9018532
2-[2-[2-(3-methylbutoxy)ethylamino]-2-oxoethoxy]-N-phenylbenzamide
CID 60529536
2-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethoxy]-N-phenylbenzamide
CID 40616574
2-[2-oxo-2-[[(2R)-3-oxo-1-phenylbutan-2-yl]amino]ethoxy]-N-phenylbenzamide
CID 7981006
2-(2-acetamidophenoxy)-N-[(2S)-5-methylhexan-2-yl]acetamide
CID 9018049
N-[4-[2-[[(2R)-butan-2-yl]amino]-2-oxoethoxy]phenyl]-2-methoxybenzamide
CID 9318169
2-(3-methylbutoxy)-N-[4-(propanoylamino)phenyl]benzamide
CID 17204895
2-methoxy-N-[4-[2-[[(2S)-1-methoxypropan-2-yl]amino]-2-oxoethoxy]phenyl]benzamide
CID 9114687
2-(2-acetylphenoxy)-N-pentan-2-ylacetamide
CID 60626000
2-[2-(3,5-dimethylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 7980967
N-(4-benzamidophenyl)-2-(3-methylbutoxy)benzamide
CID 17235412
2-[2-(3-methylanilino)-2-oxoethoxy]-N-phenylbenzamide
CID 2709122

Frequently Asked Questions

What is the IUPAC name of 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide?
The IUPAC name of 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide (CID 9018570) is 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide.
What is the SMILES notation for 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide?
The canonical SMILES for 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide is CC(C)CC[C@@H](C)NC(=O)COc1ccccc1C(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide?
The InChIKey is RCFWGLRVKXWXTN-QGZVFWFLSA-N. The full InChI is InChI=1S/C22H28N2O3/c1-16(2)13-14-17(3)23-21(25)15-27-20-12-8-7-11-19(20)22(26)24-18-9-5-4-6-10-18/h4-12,16-17H,13-15H2,1-3H3,(H,23,25)(H,24,26)/t17-/m1/s1.
What are the key properties of 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide?
2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide has a molecular weight of 368.48 g/mol, XLogP of 4.26, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[[(2R)-5-methylhexan-2-yl]amino]-2-oxoethoxy]-N-phenylbenzamide is sourced from PubChem (CID 9018570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).