N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide

C19H22N2O2 — CID 2942993

IUPACN-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide
SMILESCCC(C)NC(=O)c1ccccc1NC(=O)c1ccc(C)cc1
InChIInChI=1S/C19H22N2O2/c1-4-14(3)20-19(23)16-7-5-6-8-17(16)21-18(22)15-11-9-13(2)10-12-15/h5-12,14H,4H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyJZLAJQKVYTYDEY-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.78
Rot. Bonds5

About N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide

N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide (PubChem CID 2942993) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide.

Molecular Properties

Compound NameN-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide
PubChem CID2942993
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide
SMILESCCC(C)NC(=O)c1ccccc1NC(=O)c1ccc(C)cc1
InChIInChI=1S/C19H22N2O2/c1-4-14(3)20-19(23)16-7-5-6-8-17(16)21-18(22)15-11-9-13(2)10-12-15/h5-12,14H,4H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyJZLAJQKVYTYDEY-UHFFFAOYSA-N
XLogP3.78
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-butan-2-yl]-2-[(4-methylbenzoyl)amino]benzamide
CID 893770
N-butan-2-yl-2-[(4-fluorobenzoyl)amino]benzamide
CID 2943228
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2,4-dimethylbenzamide
CID 34734992
N-butan-2-yl-2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzamide
CID 2947855
N-butan-2-yl-2-[[4-(methanesulfonamido)benzoyl]amino]benzamide
CID 2968059
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-2,4,5-trimethylbenzamide
CID 100708807
N-[2-[[(2R)-butan-2-yl]carbamoyl]phenyl]-4-methyl-3-[(4-methylphenyl)sulfamoyl]benzamide
CID 126413495
N-[2-[[(2S)-butan-2-yl]carbamoyl]phenyl]-2-chloro-4-methylbenzamide
CID 100520474
N-[(2S)-butan-2-yl]-2-[(4-prop-2-enoxybenzoyl)amino]benzamide
CID 9172934
N-[(2S)-butan-2-yl]-2-[(2-iodobenzoyl)amino]benzamide
CID 26244706
N-[(2S)-butan-2-yl]-2-[[2-(4-methylphenyl)sulfanylacetyl]amino]benzamide
CID 34736203
N-[(2R)-butan-2-yl]-2-[[(E)-3-(4-methylphenyl)prop-2-enoyl]amino]benzamide
CID 34735632

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide?
The IUPAC name of N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide (CID 2942993) is N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide.
What is the SMILES notation for N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide?
The canonical SMILES for N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide is CCC(C)NC(=O)c1ccccc1NC(=O)c1ccc(C)cc1.
What is the InChIKey of N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide?
The InChIKey is JZLAJQKVYTYDEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-4-14(3)20-19(23)16-7-5-6-8-17(16)21-18(22)15-11-9-13(2)10-12-15/h5-12,14H,4H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide?
N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide has a molecular weight of 310.40 g/mol, XLogP of 3.78, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-2-[(4-methylbenzoyl)amino]benzamide is sourced from PubChem (CID 2942993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).