N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide

C19H20N2O2 — CID 16567528

IUPACN-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H20N2O2/c1-12-8-13(2)10-15(9-12)19(23)21-17-5-3-4-14(11-17)18(22)20-16-6-7-16/h3-5,8-11,16H,6-7H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyUFAAXEMHUOAEOK-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.45
Rot. Bonds4

About N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide

N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide (PubChem CID 16567528) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
PubChem CID16567528
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC NameN-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide
SMILESCc1cc(C)cc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H20N2O2/c1-12-8-13(2)10-15(9-12)19(23)21-17-5-3-4-14(11-17)18(22)20-16-6-7-16/h3-5,8-11,16H,6-7H2,1-2H3,(H,20,22)(H,21,23)
InChIKeyUFAAXEMHUOAEOK-UHFFFAOYSA-N
XLogP3.45
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide
CID 2221852
1-N-cyclopropyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109043347
methyl 3-[[3-(cyclopropylcarbamoyl)benzoyl]amino]benzoate
CID 109050811
3-[(4-tert-butylbenzoyl)amino]-N-cyclopropylbenzamide
CID 26110808
3-(cyclopropanecarbonylamino)-N-[3-(cyclopropylcarbamoyl)phenyl]benzamide
CID 30127139
1-N-(3-acetylphenyl)-3-N-cyclopentylbenzene-1,3-dicarboxamide
CID 109051927
N-(3-acetylphenyl)-3,5-dimethylbenzamide
CID 969392
3-(carbamoylamino)-N-cyclopropylbenzamide
CID 9210111
3-acetamido-N-(4-hydroxycyclohexyl)benzamide
CID 43389328
N-[3-(cyclopropylcarbamoyl)phenyl]-3-methylthiophene-2-carboxamide
CID 17415846
1-N-cyclopentyl-4-N-(3-methylphenyl)benzene-1,4-dicarboxamide
CID 109044466
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide (CID 16567528) is N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide is Cc1cc(C)cc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)c1.
What is the InChIKey of N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide?
The InChIKey is UFAAXEMHUOAEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-12-8-13(2)10-15(9-12)19(23)21-17-5-3-4-14(11-17)18(22)20-16-6-7-16/h3-5,8-11,16H,6-7H2,1-2H3,(H,20,22)(H,21,23).
What are the key properties of N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide?
N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide has a molecular weight of 308.38 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylcarbamoyl)phenyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 16567528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).