N-cyclopropyl-N-methyl-2-(propylamino)benzamide

C14H20N2O — CID 62169629

IUPACN-cyclopropyl-N-methyl-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)N(C)C1CC1
InChIInChI=1S/C14H20N2O/c1-3-10-15-13-7-5-4-6-12(13)14(17)16(2)11-8-9-11/h4-7,11,15H,3,8-10H2,1-2H3
InChIKeyOFQYFXOCYNFIIZ-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.74
Rot. Bonds5

About N-cyclopropyl-N-methyl-2-(propylamino)benzamide

N-cyclopropyl-N-methyl-2-(propylamino)benzamide (PubChem CID 62169629) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-(propylamino)benzamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-(propylamino)benzamide
PubChem CID62169629
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC NameN-cyclopropyl-N-methyl-2-(propylamino)benzamide
SMILESCCCNc1ccccc1C(=O)N(C)C1CC1
InChIInChI=1S/C14H20N2O/c1-3-10-15-13-7-5-4-6-12(13)14(17)16(2)11-8-9-11/h4-7,11,15H,3,8-10H2,1-2H3
InChIKeyOFQYFXOCYNFIIZ-UHFFFAOYSA-N
XLogP2.74
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-(propylamino)benzamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-(propylamino)benzamide (CID 62169629) is N-cyclopropyl-N-methyl-2-(propylamino)benzamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-(propylamino)benzamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-(propylamino)benzamide is CCCNc1ccccc1C(=O)N(C)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-(propylamino)benzamide?
The InChIKey is OFQYFXOCYNFIIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-3-10-15-13-7-5-4-6-12(13)14(17)16(2)11-8-9-11/h4-7,11,15H,3,8-10H2,1-2H3.
What are the key properties of N-cyclopropyl-N-methyl-2-(propylamino)benzamide?
N-cyclopropyl-N-methyl-2-(propylamino)benzamide has a molecular weight of 232.33 g/mol, XLogP of 2.74, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-(propylamino)benzamide is sourced from PubChem (CID 62169629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).