5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide

C16H20N6O2 — CID 71547914

IUPAC5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
SMILESCc1cc(C)nc(Nc2cc(NC(C)C(N)=O)cnc2C(N)=O)c1
InChIInChI=1S/C16H20N6O2/c1-8-4-9(2)20-13(5-8)22-12-6-11(21-10(3)15(17)23)7-19-14(12)16(18)24/h4-7,10,21H,1-3H3,(H2,17,23)(H2,18,24)(H,20,22)
InChIKeyOWPBEMOACKMSLP-UHFFFAOYSA-N
MW328.38 g/mol
LogP1.22
Rot. Bonds6

About 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide

5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide (PubChem CID 71547914) has the molecular formula C16H20N6O2 and a molecular weight of 328.38 g/mol. Its IUPAC name is 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
PubChem CID71547914
Molecular FormulaC16H20N6O2
Molecular Weight328.38 g/mol
Exact Mass328.16
IUPAC Name5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
SMILESCc1cc(C)nc(Nc2cc(NC(C)C(N)=O)cnc2C(N)=O)c1
InChIInChI=1S/C16H20N6O2/c1-8-4-9(2)20-13(5-8)22-12-6-11(21-10(3)15(17)23)7-19-14(12)16(18)24/h4-7,10,21H,1-3H3,(H2,17,23)(H2,18,24)(H,20,22)
InChIKeyOWPBEMOACKMSLP-UHFFFAOYSA-N
XLogP1.22
TPSA136.02 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 51.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide 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-[(1-amino-4-methyl-1-oxopentan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 78107274
5-(2-aminopropylamino)-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 71547341
5-[[2-amino-3-(dimethylamino)-3-oxopropyl]amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 90354146
3-[(4,6-dimethyl-2-pyridinyl)amino]-5-(piperidin-4-ylamino)pyridine-2-carboxamide
CID 90354419
2-amino-3-[[6-cyano-5-[(4,6-dimethyl-2-pyridinyl)amino]-3-pyridinyl]amino]-N-methylpropanamide
CID 89486875
[3-[[6-cyano-5-[(4,6-dimethyl-2-pyridinyl)amino]-3-pyridinyl]amino]-1-(methylamino)-1-oxopropan-2-yl]carbamic acid
CID 89486826
5-[[(2R)-1-amino-3-methyl-1-oxobutan-2-yl]amino]-3-[(3-cyclopropyl-1,2-oxazol-5-yl)amino]pyridine-2-carboxamide
CID 90098267
5-(2-aminopropylamino)-3-[(6-ethyl-2-pyridinyl)amino]pyridine-2-carboxamide
CID 71547581
2-(4-fluoro-3,5-dimethylanilino)propanamide
CID 143730573
4-[[(1S,2R)-2-aminocyclohexyl]amino]-2-[(4,6-dimethyl-2-pyridinyl)amino]benzamide
CID 71523126
2-[(6-amino-2-methylpyrimidin-4-yl)amino]propanamide
CID 80788207
5-[[(1R,2S)-2-aminocyclohexyl]amino]-3-[[6-methyl-4-(2-methylpyrazol-3-yl)-2-pyridinyl]amino]pyridine-2-carboxamide
CID 90354456

Frequently Asked Questions

What is the IUPAC name of 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The IUPAC name of 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide (CID 71547914) is 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide.
What is the SMILES notation for 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The canonical SMILES for 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide is Cc1cc(C)nc(Nc2cc(NC(C)C(N)=O)cnc2C(N)=O)c1.
What is the InChIKey of 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide?
The InChIKey is OWPBEMOACKMSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N6O2/c1-8-4-9(2)20-13(5-8)22-12-6-11(21-10(3)15(17)23)7-19-14(12)16(18)24/h4-7,10,21H,1-3H3,(H2,17,23)(H2,18,24)(H,20,22).
What are the key properties of 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide?
5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide has a molecular weight of 328.38 g/mol, XLogP of 1.22, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1-amino-1-oxopropan-2-yl)amino]-3-[(4,6-dimethyl-2-pyridinyl)amino]pyridine-2-carboxamide is sourced from PubChem (CID 71547914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).