N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide

C13H21N3O — CID 60671493

IUPACN-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide
SMILESCC(C)CCNC(=O)CNCc1ccccn1
InChIInChI=1S/C13H21N3O/c1-11(2)6-8-16-13(17)10-14-9-12-5-3-4-7-15-12/h3-5,7,11,14H,6,8-10H2,1-2H3,(H,16,17)
InChIKeyAAFWDLGEMJBCHT-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.33
Rot. Bonds7

About N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide

N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide (PubChem CID 60671493) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide
PubChem CID60671493
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide
SMILESCC(C)CCNC(=O)CNCc1ccccn1
InChIInChI=1S/C13H21N3O/c1-11(2)6-8-16-13(17)10-14-9-12-5-3-4-7-15-12/h3-5,7,11,14H,6,8-10H2,1-2H3,(H,16,17)
InChIKeyAAFWDLGEMJBCHT-UHFFFAOYSA-N
XLogP1.33
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide 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

N-(2-phenylethyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 108999079
N-(3-methoxypropyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 60647529
N-(cyanomethyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 28583464
3-N-(3-methylbutyl)-5-N-(pyridin-2-ylmethyl)pyridine-3,5-dicarboxamide
CID 109105910
4-hydroxy-N-(pyridin-2-ylmethyl)pentanamide
CID 79016708
N-[2-oxo-2-(pyridin-2-ylmethylamino)ethyl]propanamide
CID 47412168
2-methyl-N-(pyridin-2-ylmethyl)propan-1-amine;hydrochloride
CID 17332283
(2S)-3-phenyl-2-[[2-(pyridin-2-ylmethylamino)acetyl]amino]propanoic acid
CID 68875961
2-(3-methylbutylamino)-N-(pyridin-2-ylmethyl)pyrimidine-4-carboxamide
CID 109307058
N-(3-chloro-4-methylphenyl)-2-(pyridin-2-ylmethylamino)acetamide
CID 108999138
2-methyl-N-[2-(pyridin-2-ylmethylcarbamoylamino)ethyl]propanamide
CID 47126081
N-(3-methylbutyl)-3-(pyridin-2-ylmethylsulfamoyl)benzamide
CID 109064786

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide?
The IUPAC name of N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide (CID 60671493) is N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide.
What is the SMILES notation for N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide?
The canonical SMILES for N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide is CC(C)CCNC(=O)CNCc1ccccn1.
What is the InChIKey of N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide?
The InChIKey is AAFWDLGEMJBCHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-11(2)6-8-16-13(17)10-14-9-12-5-3-4-7-15-12/h3-5,7,11,14H,6,8-10H2,1-2H3,(H,16,17).
What are the key properties of N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide?
N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide has a molecular weight of 235.33 g/mol, XLogP of 1.33, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-2-(pyridin-2-ylmethylamino)acetamide is sourced from PubChem (CID 60671493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).