2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide

C19H24N2O — CID 154320890

IUPAC2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide
SMILESCCCC(C)Nc1cccc(NC(=O)c2ccccc2C)c1
InChIInChI=1S/C19H24N2O/c1-4-8-15(3)20-16-10-7-11-17(13-16)21-19(22)18-12-6-5-9-14(18)2/h5-7,9-13,15,20H,4,8H2,1-3H3,(H,21,22)
InChIKeyPEVQARAUCAKBFU-UHFFFAOYSA-N
MW296.41 g/mol
LogP4.85
Rot. Bonds6

About 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide

2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide (PubChem CID 154320890) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide.

Molecular Properties

Compound Name2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide
PubChem CID154320890
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide
SMILESCCCC(C)Nc1cccc(NC(=O)c2ccccc2C)c1
InChIInChI=1S/C19H24N2O/c1-4-8-15(3)20-16-10-7-11-17(13-16)21-19(22)18-12-6-5-9-14(18)2/h5-7,9-13,15,20H,4,8H2,1-3H3,(H,21,22)
InChIKeyPEVQARAUCAKBFU-UHFFFAOYSA-N
XLogP4.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 54.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide?
The IUPAC name of 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide (CID 154320890) is 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide.
What is the SMILES notation for 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide?
The canonical SMILES for 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide is CCCC(C)Nc1cccc(NC(=O)c2ccccc2C)c1.
What is the InChIKey of 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide?
The InChIKey is PEVQARAUCAKBFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-4-8-15(3)20-16-10-7-11-17(13-16)21-19(22)18-12-6-5-9-14(18)2/h5-7,9-13,15,20H,4,8H2,1-3H3,(H,21,22).
What are the key properties of 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide?
2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide has a molecular weight of 296.41 g/mol, XLogP of 4.85, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[3-(pentan-2-ylamino)phenyl]benzamide is sourced from PubChem (CID 154320890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).