3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide

C11H17N3O — CID 106097095

IUPAC3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide
SMILESCc1ccnc(NC(C)(C)CC(N)=O)c1
InChIInChI=1S/C11H17N3O/c1-8-4-5-13-10(6-8)14-11(2,3)7-9(12)15/h4-6H,7H2,1-3H3,(H2,12,15)(H,13,14)
InChIKeyGRFBIVJYDFZRQC-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.46
Rot. Bonds4

About 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide

3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide (PubChem CID 106097095) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide.

Molecular Properties

Compound Name3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide
PubChem CID106097095
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide
SMILESCc1ccnc(NC(C)(C)CC(N)=O)c1
InChIInChI=1S/C11H17N3O/c1-8-4-5-13-10(6-8)14-11(2,3)7-9(12)15/h4-6H,7H2,1-3H3,(H2,12,15)(H,13,14)
InChIKeyGRFBIVJYDFZRQC-UHFFFAOYSA-N
XLogP1.46
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide 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

3-[(4-amino-2-pyridinyl)amino]-3-methylbutanamide
CID 106095700
3-[(6-chloro-2-methylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098086
3-[(6-bromo-2-methylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098033
3-[[6-(ethylamino)-2-methylpyrimidin-4-yl]amino]-3-methylbutanamide
CID 106098719
2-[(4-amino-2-methyl-4-oxobutan-2-yl)amino]-5-chloropyridine-4-carboxylic acid
CID 106096927
N-(4-amino-2-methyl-4-oxobutan-2-yl)-2-(ethylamino)pyridine-4-carboxamide
CID 106098402
methyl 6-[(4-amino-2-methyl-4-oxobutan-2-yl)amino]-2-methylpyridine-3-carboxylate
CID 106097210
3-methyl-3-[(2-methylpyrimidin-4-yl)amino]butanoic acid
CID 64701760
2,2-difluoro-3-[(4-methyl-2-pyridinyl)amino]propan-1-ol
CID 104858561
3-[(2-tert-butyl-6-hydrazinylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098870
3-[(4-amino-6-chloro-2-pyridinyl)amino]-3-methylbutanamide
CID 106095681
2,2,2-trifluoro-N-(4-methyl-2-pyridinyl)acetamide
CID 3568056

Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide?
The IUPAC name of 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide (CID 106097095) is 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide.
What is the SMILES notation for 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide?
The canonical SMILES for 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide is Cc1ccnc(NC(C)(C)CC(N)=O)c1.
What is the InChIKey of 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide?
The InChIKey is GRFBIVJYDFZRQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-8-4-5-13-10(6-8)14-11(2,3)7-9(12)15/h4-6H,7H2,1-3H3,(H2,12,15)(H,13,14).
What are the key properties of 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide?
3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide has a molecular weight of 207.28 g/mol, XLogP of 1.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-[(4-methyl-2-pyridinyl)amino]butanamide is sourced from PubChem (CID 106097095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).