2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide

C12H20N4O — CID 113406565

IUPAC2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
SMILESCc1cnc(NC(C)C(=O)NC(C)C)cc1N
InChIInChI=1S/C12H20N4O/c1-7(2)15-12(17)9(4)16-11-5-10(13)8(3)6-14-11/h5-7,9H,1-4H3,(H,15,17)(H3,13,14,16)
InChIKeyIDFUFPGIUHYKDT-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.30
Rot. Bonds4

About 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide

2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide (PubChem CID 113406565) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
PubChem CID113406565
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
SMILESCc1cnc(NC(C)C(=O)NC(C)C)cc1N
InChIInChI=1S/C12H20N4O/c1-7(2)15-12(17)9(4)16-11-5-10(13)8(3)6-14-11/h5-7,9H,1-4H3,(H,15,17)(H3,13,14,16)
InChIKeyIDFUFPGIUHYKDT-UHFFFAOYSA-N
XLogP1.30
TPSA80.04 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
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

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Related Compounds

2-[(4-amino-5-methyl-2-pyridinyl)amino]-N,N-diethylpropanamide
CID 113408305
N-(4-amino-5-methyl-2-pyridinyl)acetamide
CID 66747868
2-[(6-methylsulfanylpyrimidin-4-yl)amino]-N-propan-2-ylpropanamide
CID 106972987
5-methyl-2-N-(1-phenylethyl)pyridine-2,4-diamine
CID 83265107
2-N-[4-(dimethylamino)butan-2-yl]-5-methylpyridine-2,4-diamine
CID 83265237
2-[(4-carbamothioyl-6-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
CID 114767933
2-[[6-amino-4-(trifluoromethyl)-2-pyridinyl]amino]-N-propan-2-ylpropanamide
CID 102719169
2-(3,5-dimethylanilino)-N-propan-2-ylpropanamide
CID 43084818
5-methyl-2-N-(1-pyridin-2-ylethyl)pyridine-2,4-diamine
CID 83266097
2-[(4-cyano-6-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide
CID 114766584
5-methyl-2-N-(1-thiophen-3-ylethyl)pyridine-2,4-diamine
CID 83265635
3-[(4-amino-5-methyl-2-pyridinyl)amino]-2,2-dimethylpropanamide
CID 106275165

Frequently Asked Questions

What is the IUPAC name of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide?
The IUPAC name of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide (CID 113406565) is 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide is Cc1cnc(NC(C)C(=O)NC(C)C)cc1N.
What is the InChIKey of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide?
The InChIKey is IDFUFPGIUHYKDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-7(2)15-12(17)9(4)16-11-5-10(13)8(3)6-14-11/h5-7,9H,1-4H3,(H,15,17)(H3,13,14,16).
What are the key properties of 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide?
2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide has a molecular weight of 236.32 g/mol, XLogP of 1.30, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-amino-5-methyl-2-pyridinyl)amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 113406565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).