N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide

C17H20N2O — CID 63107622

IUPACN-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
SMILESCc1ccccc1NC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C17H20N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h4-12,18H,1-3H3,(H,19,20)
InChIKeyCRPHCDQWWPSJOZ-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.07
Rot. Bonds4

About N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide

N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide (PubChem CID 63107622) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
PubChem CID63107622
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC NameN-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
SMILESCc1ccccc1NC(=O)c1ccccc1NC(C)C
InChIInChI=1S/C17H20N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h4-12,18H,1-3H3,(H,19,20)
InChIKeyCRPHCDQWWPSJOZ-UHFFFAOYSA-N
XLogP4.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyanophenyl)-2-(propan-2-ylamino)benzamide
CID 63107973
2-(propan-2-ylamino)-N-thiophen-3-ylbenzamide
CID 66354382
N-ethyl-2-(propan-2-ylamino)benzamide
CID 63107552
3-hydroxy-2-methyl-N-(2-methylphenyl)benzamide
CID 82786919
N-(2,3-dimethylphenyl)-2-(propan-2-ylcarbamoylamino)benzamide
CID 51216735
2-methyl-N-[4-(propan-2-ylamino)phenyl]benzamide
CID 112979818
2-[2-[(2-methylphenyl)carbamoyl]phenyl]benzoic acid
CID 777419
2-[2-[(2-methylphenyl)carbamoyl]phenyl]benzoate
CID 4052008
N-(1,3-dihydroxypropan-2-yl)-2-(propan-2-ylamino)benzamide
CID 65313573
2-(propan-2-ylamino)-N-(1,3-thiazol-2-yl)benzamide
CID 63107522
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
N-(2-methylphenyl)-1H-pyrrole-2-carboxamide
CID 47009571

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide?
The IUPAC name of N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide (CID 63107622) is N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide.
What is the SMILES notation for N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide?
The canonical SMILES for N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide is Cc1ccccc1NC(=O)c1ccccc1NC(C)C.
What is the InChIKey of N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide?
The InChIKey is CRPHCDQWWPSJOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-12(2)18-16-11-7-5-9-14(16)17(20)19-15-10-6-4-8-13(15)3/h4-12,18H,1-3H3,(H,19,20).
What are the key properties of N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide?
N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide has a molecular weight of 268.36 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide is sourced from PubChem (CID 63107622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).