5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide

C15H22N2O — CID 113485988

IUPAC5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1(C)CC1
InChIInChI=1S/C15H22N2O/c1-4-9-16-13-6-5-11(2)10-12(13)14(18)17-15(3)7-8-15/h5-6,10,16H,4,7-9H2,1-3H3,(H,17,18)
InChIKeyZHQAYRVPFQLDJT-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.10
Rot. Bonds5

About 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide

5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide (PubChem CID 113485988) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide.

Molecular Properties

Compound Name5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
PubChem CID113485988
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC1(C)CC1
InChIInChI=1S/C15H22N2O/c1-4-9-16-13-6-5-11(2)10-12(13)14(18)17-15(3)7-8-15/h5-6,10,16H,4,7-9H2,1-3H3,(H,17,18)
InChIKeyZHQAYRVPFQLDJT-UHFFFAOYSA-N
XLogP3.10
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499534
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-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
CID 62510099
N-(1-methylcyclopentyl)-4-(propylamino)pyridine-3-carboxamide
CID 81245301
2-(ethylamino)-5-methyl-N-propylbenzamide
CID 62509654
N-(4-chlorophenyl)-5-methyl-2-(propylamino)benzamide
CID 63501109
N-(4-fluorophenyl)-5-methyl-2-(propylamino)benzamide
CID 62510349
5-methyl-2-(propylamino)-N-pyrimidin-5-ylbenzamide
CID 107589993
N-(4-iodophenyl)-5-methyl-2-(propylamino)benzamide
CID 63499323
5-methyl-N-(1-methylsulfonylpropan-2-yl)-2-(propylamino)benzamide
CID 64642886

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide?
The IUPAC name of 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide (CID 113485988) is 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide.
What is the SMILES notation for 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide?
The canonical SMILES for 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)NC1(C)CC1.
What is the InChIKey of 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide?
The InChIKey is ZHQAYRVPFQLDJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-4-9-16-13-6-5-11(2)10-12(13)14(18)17-15(3)7-8-15/h5-6,10,16H,4,7-9H2,1-3H3,(H,17,18).
What are the key properties of 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide?
5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide has a molecular weight of 246.35 g/mol, XLogP of 3.10, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide is sourced from PubChem (CID 113485988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).