N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide

C18H26N2O — CID 62510099

IUPACN-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC(C1CC1)C1CC1
InChIInChI=1S/C18H26N2O/c1-3-10-19-16-9-4-12(2)11-15(16)18(21)20-17(13-5-6-13)14-7-8-14/h4,9,11,13-14,17,19H,3,5-8,10H2,1-2H3,(H,20,21)
InChIKeyJZORPEFWELVPIZ-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.74
Rot. Bonds7

About N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide

N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide (PubChem CID 62510099) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
PubChem CID62510099
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC(C1CC1)C1CC1
InChIInChI=1S/C18H26N2O/c1-3-10-19-16-9-4-12(2)11-15(16)18(21)20-17(13-5-6-13)14-7-8-14/h4,9,11,13-14,17,19H,3,5-8,10H2,1-2H3,(H,20,21)
InChIKeyJZORPEFWELVPIZ-UHFFFAOYSA-N
XLogP3.74
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-(dicyclopropylmethyl)-2-(propylamino)benzamide
CID 62177457
N-(dicyclopropylmethyl)-5-methyl-2-(methylamino)benzamide
CID 62509943
5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
CID 55083225
N-cyclohexyl-5-methyl-2-(propylamino)benzamide
CID 62509311
5-methyl-N-(4-methylcyclohexyl)-2-(propylamino)benzamide
CID 63500938
N-(4-chlorophenyl)-5-methyl-2-(propylamino)benzamide
CID 63501109
5-methyl-N-(1-methylsulfonylpropan-2-yl)-2-(propylamino)benzamide
CID 64642886
N-(1-ethoxypropan-2-yl)-5-methyl-2-(propylamino)benzamide
CID 62510998
5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
CID 113485988
2-(dicyclopropylmethylcarbamoyl)-4-methylbenzenesulfonyl chloride
CID 65454123
N-(4-iodophenyl)-5-methyl-2-(propylamino)benzamide
CID 63499323
5-methyl-2-(propylamino)-N-pyrimidin-5-ylbenzamide
CID 107589993

Frequently Asked Questions

What is the IUPAC name of N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide?
The IUPAC name of N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide (CID 62510099) is N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide.
What is the SMILES notation for N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide?
The canonical SMILES for N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)NC(C1CC1)C1CC1.
What is the InChIKey of N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide?
The InChIKey is JZORPEFWELVPIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-3-10-19-16-9-4-12(2)11-15(16)18(21)20-17(13-5-6-13)14-7-8-14/h4,9,11,13-14,17,19H,3,5-8,10H2,1-2H3,(H,20,21).
What are the key properties of N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide?
N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide has a molecular weight of 286.42 g/mol, XLogP of 3.74, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide is sourced from PubChem (CID 62510099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).