2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide

C19H22N2O2 — CID 78814473

IUPAC2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide
SMILESCC(C)Cc1ccc(CC(=O)Nc2ccccc2C(N)=O)cc1
InChIInChI=1S/C19H22N2O2/c1-13(2)11-14-7-9-15(10-8-14)12-18(22)21-17-6-4-3-5-16(17)19(20)23/h3-10,13H,11-12H2,1-2H3,(H2,20,23)(H,21,22)
InChIKeySHIZMUWCSATPMR-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.17
Rot. Bonds6

About 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide

2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide (PubChem CID 78814473) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide
PubChem CID78814473
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide
SMILESCC(C)Cc1ccc(CC(=O)Nc2ccccc2C(N)=O)cc1
InChIInChI=1S/C19H22N2O2/c1-13(2)11-14-7-9-15(10-8-14)12-18(22)21-17-6-4-3-5-16(17)19(20)23/h3-10,13H,11-12H2,1-2H3,(H2,20,23)(H,21,22)
InChIKeySHIZMUWCSATPMR-UHFFFAOYSA-N
XLogP3.17
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

S-[2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56576978
2-[[(2R)-2-bromo-4-methylpentanoyl]amino]benzamide
CID 825309
2-(4-aminopentanoylamino)benzamide;hydrochloride
CID 120558709
2-[(2-amino-4-methylpentanoyl)amino]benzamide
CID 24702801
2-(2-bromopropanoylamino)benzamide
CID 14588064
2-(3-aminopropanoylamino)benzamide
CID 22692052
2-[[4-[(2-phenylacetyl)amino]benzoyl]amino]benzamide
CID 17119515
methyl 3-(2-carbamoylanilino)-3-oxopropanoate
CID 25049818
2-(2-bromobutanoylamino)benzamide
CID 23323526
(2S)-2-[2-(2-carbamoylanilino)-2-oxoethoxy]propanoic acid
CID 104875798
2-[[2-(3-hydroxybutan-2-ylsulfanyl)acetyl]amino]benzamide
CID 107771195
2-[[2-(4-aminophenyl)acetyl]amino]-N-(1-phenylethyl)benzamide
CID 54795752

Frequently Asked Questions

What is the IUPAC name of 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide?
The IUPAC name of 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide (CID 78814473) is 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide.
What is the SMILES notation for 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide?
The canonical SMILES for 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide is CC(C)Cc1ccc(CC(=O)Nc2ccccc2C(N)=O)cc1.
What is the InChIKey of 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide?
The InChIKey is SHIZMUWCSATPMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-13(2)11-14-7-9-15(10-8-14)12-18(22)21-17-6-4-3-5-16(17)19(20)23/h3-10,13H,11-12H2,1-2H3,(H2,20,23)(H,21,22).
What are the key properties of 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide?
2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.17, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[4-(2-methylpropyl)phenyl]acetyl]amino]benzamide is sourced from PubChem (CID 78814473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).