2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide

C12H20N4O — CID 115356046

IUPAC2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide
SMILESCc1nc(NCC(=O)NC(C)(C)C)ccc1N
InChIInChI=1S/C12H20N4O/c1-8-9(13)5-6-10(15-8)14-7-11(17)16-12(2,3)4/h5-6H,7,13H2,1-4H3,(H,14,15)(H,16,17)
InChIKeyOZQJKXFHBVRDNV-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.30
Rot. Bonds3

About 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide

2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide (PubChem CID 115356046) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide.

Molecular Properties

Compound Name2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide
PubChem CID115356046
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide
SMILESCc1nc(NCC(=O)NC(C)(C)C)ccc1N
InChIInChI=1S/C12H20N4O/c1-8-9(13)5-6-10(15-8)14-7-11(17)16-12(2,3)4/h5-6H,7,13H2,1-4H3,(H,14,15)(H,16,17)
InChIKeyOZQJKXFHBVRDNV-UHFFFAOYSA-N
XLogP1.30
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide 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-(5-amino-6-methyl-2-pyridinyl)propanamide
CID 82330911
N-tert-butyl-2-(pyrido[2,3-b]pyrazin-6-ylamino)acetamide
CID 78988508
N-tert-butyl-2-[(2-hydrazinylpyrimidin-4-yl)amino]acetamide
CID 115357503
2-[[2-amino-6-(methylamino)pyrimidin-4-yl]amino]-N-tert-butylacetamide
CID 113293339
4-[(5-amino-6-methyl-2-pyridinyl)amino]butanoic acid
CID 82060932
6-[[2-(tert-butylamino)-2-oxoethyl]amino]pyridazine-3-carboxylic acid
CID 115356492
2-amino-5-[[2-(tert-butylamino)-2-oxoethyl]amino]benzamide
CID 115357122
N-tert-butyl-2-[(5-chloro-2-pyridinyl)amino]acetamide
CID 79035029
N-tert-butyl-2-[(6-hydrazinylpyrazin-2-yl)amino]acetamide
CID 115357509
2-(2-amino-6-methylanilino)-N-tert-butylacetamide
CID 115550766
2-[[5-amino-6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]amino]-N-methylacetamide
CID 43310372
2-[(7-amino-2,1,3-benzoxadiazol-4-yl)amino]-N-tert-butylacetamide
CID 115356002

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide?
The IUPAC name of 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide (CID 115356046) is 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide.
What is the SMILES notation for 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide?
The canonical SMILES for 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide is Cc1nc(NCC(=O)NC(C)(C)C)ccc1N.
What is the InChIKey of 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide?
The InChIKey is OZQJKXFHBVRDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8-9(13)5-6-10(15-8)14-7-11(17)16-12(2,3)4/h5-6H,7,13H2,1-4H3,(H,14,15)(H,16,17).
What are the key properties of 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide?
2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide has a molecular weight of 236.32 g/mol, XLogP of 1.30, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-methyl-2-pyridinyl)amino]-N-tert-butylacetamide is sourced from PubChem (CID 115356046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).