5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide

C16H26N2O — CID 55083225

IUPAC5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC(C)C(C)C
InChIInChI=1S/C16H26N2O/c1-6-9-17-15-8-7-12(4)10-14(15)16(19)18-13(5)11(2)3/h7-8,10-11,13,17H,6,9H2,1-5H3,(H,18,19)
InChIKeyKSOWMQYWJTWRFO-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.59
Rot. Bonds6

About 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide

5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide (PubChem CID 55083225) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide.

Molecular Properties

Compound Name5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
PubChem CID55083225
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
SMILESCCCNc1ccc(C)cc1C(=O)NC(C)C(C)C
InChIInChI=1S/C16H26N2O/c1-6-9-17-15-8-7-12(4)10-14(15)16(19)18-13(5)11(2)3/h7-8,10-11,13,17H,6,9H2,1-5H3,(H,18,19)
InChIKeyKSOWMQYWJTWRFO-UHFFFAOYSA-N
XLogP3.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide
CID 55042381
5-methyl-N-(1-methylsulfonylpropan-2-yl)-2-(propylamino)benzamide
CID 64642886
N-(1-ethoxypropan-2-yl)-5-methyl-2-(propylamino)benzamide
CID 62510998
N-(dicyclopropylmethyl)-5-methyl-2-(propylamino)benzamide
CID 62510099
5-methyl-N-(1-methylcyclopropyl)-2-(propylamino)benzamide
CID 113485988
N-(4-chlorophenyl)-5-methyl-2-(propylamino)benzamide
CID 63501109
N-[3-(dimethylamino)propyl]-5-methyl-2-(propylamino)benzamide
CID 62510706
5-methyl-N-(3-methylsulfanylpropyl)-2-(propylamino)benzamide
CID 63962306
5-methyl-N-(1-methylcyclohexyl)-2-(propylamino)benzamide
CID 63499534
2-(ethylamino)-5-methyl-N-propylbenzamide
CID 62509654
N-(4-iodophenyl)-5-methyl-2-(propylamino)benzamide
CID 63499323
N,5-dimethyl-N-(2-methylpropyl)-2-(propylamino)benzamide
CID 55083322

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide?
The IUPAC name of 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide (CID 55083225) is 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide.
What is the SMILES notation for 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide?
The canonical SMILES for 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide is CCCNc1ccc(C)cc1C(=O)NC(C)C(C)C.
What is the InChIKey of 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide?
The InChIKey is KSOWMQYWJTWRFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-6-9-17-15-8-7-12(4)10-14(15)16(19)18-13(5)11(2)3/h7-8,10-11,13,17H,6,9H2,1-5H3,(H,18,19).
What are the key properties of 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide?
5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide has a molecular weight of 262.40 g/mol, XLogP of 3.59, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(3-methylbutan-2-yl)-2-(propylamino)benzamide is sourced from PubChem (CID 55083225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).