2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide

C12H17N5O — CID 55032242

IUPAC2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide
SMILESCc1nn(C)c2ncc(CNC(C)C(N)=O)cc12
InChIInChI=1S/C12H17N5O/c1-7-10-4-9(5-14-8(2)11(13)18)6-15-12(10)17(3)16-7/h4,6,8,14H,5H2,1-3H3,(H2,13,18)
InChIKeyMDQCHEMDHAUDSZ-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.24
Rot. Bonds4

About 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide

2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide (PubChem CID 55032242) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide.

Molecular Properties

Compound Name2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide
PubChem CID55032242
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC Name2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide
SMILESCc1nn(C)c2ncc(CNC(C)C(N)=O)cc12
InChIInChI=1S/C12H17N5O/c1-7-10-4-9(5-14-8(2)11(13)18)6-15-12(10)17(3)16-7/h4,6,8,14H,5H2,1-3H3,(H2,13,18)
InChIKeyMDQCHEMDHAUDSZ-UHFFFAOYSA-N
XLogP0.24
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide 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

2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]-N-ethyl-N-methylpropanamide
CID 103107455
N-[2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]ethyl]-2-methylpropanamide
CID 60976315
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-4-methylsulfinylbutan-2-amine
CID 115697655
(1S)-1-cyclopentyl-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]ethanamine
CID 81386392
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-ethoxypropan-2-amine
CID 63378566
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]hexan-3-amine
CID 62403177
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]octan-2-amine
CID 60976012
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-(1H-1,2,4-triazol-5-yl)ethanamine
CID 106282202
N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]-1-thiophen-3-ylethanamine
CID 63772068
4-[[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]methyl]phenol
CID 115603275
2-bromo-N-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methyl]prop-2-en-1-amine
CID 115614760
2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]-2-methylpropan-1-ol
CID 63771382

Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide?
The IUPAC name of 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide (CID 55032242) is 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide.
What is the SMILES notation for 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide?
The canonical SMILES for 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide is Cc1nn(C)c2ncc(CNC(C)C(N)=O)cc12.
What is the InChIKey of 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide?
The InChIKey is MDQCHEMDHAUDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c1-7-10-4-9(5-14-8(2)11(13)18)6-15-12(10)17(3)16-7/h4,6,8,14H,5H2,1-3H3,(H2,13,18).
What are the key properties of 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide?
2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide has a molecular weight of 247.30 g/mol, XLogP of 0.24, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-dimethylpyrazolo[5,4-b]pyridin-5-yl)methylamino]propanamide is sourced from PubChem (CID 55032242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).