2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide

C12H16N6O — CID 114194907

IUPAC2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide
SMILESCN(Cc1cnn(C)c1)c1cnc(N)cc1C(N)=O
InChIInChI=1S/C12H16N6O/c1-17(6-8-4-16-18(2)7-8)10-5-15-11(13)3-9(10)12(14)19/h3-5,7H,6H2,1-2H3,(H2,13,15)(H2,14,19)
InChIKeyXGHHDSRLHGAVCJ-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.13
Rot. Bonds4

About 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide

2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide (PubChem CID 114194907) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide
PubChem CID114194907
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC Name2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide
SMILESCN(Cc1cnn(C)c1)c1cnc(N)cc1C(N)=O
InChIInChI=1S/C12H16N6O/c1-17(6-8-4-16-18(2)7-8)10-5-15-11(13)3-9(10)12(14)19/h3-5,7H,6H2,1-2H3,(H2,13,15)(H2,14,19)
InChIKeyXGHHDSRLHGAVCJ-UHFFFAOYSA-N
XLogP0.13
TPSA103.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide (CID 114194907) is 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide is CN(Cc1cnn(C)c1)c1cnc(N)cc1C(N)=O.
What is the InChIKey of 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide?
The InChIKey is XGHHDSRLHGAVCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-17(6-8-4-16-18(2)7-8)10-5-15-11(13)3-9(10)12(14)19/h3-5,7H,6H2,1-2H3,(H2,13,15)(H2,14,19).
What are the key properties of 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide?
2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.13, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]pyridine-4-carboxamide is sourced from PubChem (CID 114194907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).