2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide

C15H18N6O — CID 56686272

IUPAC2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide
SMILESCc1nn(C)c2cn(C(C)C(=O)NCc3ccncc3)nc12
InChIInChI=1S/C15H18N6O/c1-10-14-13(20(3)18-10)9-21(19-14)11(2)15(22)17-8-12-4-6-16-7-5-12/h4-7,9,11H,8H2,1-3H3,(H,17,22)
InChIKeyJPAMSAKHUHJIOX-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.35
Rot. Bonds4

About 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide

2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide (PubChem CID 56686272) has the molecular formula C15H18N6O and a molecular weight of 298.35 g/mol. Its IUPAC name is 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide
PubChem CID56686272
Molecular FormulaC15H18N6O
Molecular Weight298.35 g/mol
Exact Mass298.15
IUPAC Name2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide
SMILESCc1nn(C)c2cn(C(C)C(=O)NCc3ccncc3)nc12
InChIInChI=1S/C15H18N6O/c1-10-14-13(20(3)18-10)9-21(19-14)11(2)15(22)17-8-12-4-6-16-7-5-12/h4-7,9,11H,8H2,1-3H3,(H,17,22)
InChIKeyJPAMSAKHUHJIOX-UHFFFAOYSA-N
XLogP1.35
TPSA77.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-methyl-N-[(2-methylpyrazol-3-yl)methyl]propanamide
CID 56686259
2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(1,1-dioxothiolan-3-yl)propanamide
CID 56686271
3-cyano-2-methyl-N-(pyridin-4-ylmethyl)propanamide
CID 82112575
2-(4-methylphenoxy)-N-(pyridin-4-ylmethyl)propanamide
CID 6490042
N-(pyridin-4-ylmethyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 47134470
(2S)-2,3-dimethyl-N-(pyridin-4-ylmethyl)butanamide;ethane;molecular hydrogen
CID 143277001
2-(3,5-dimethylphenoxy)-N-(pyridin-4-ylmethyl)propanamide
CID 53286403
2-amino-4-methyl-N-(pyridin-4-ylmethyl)pentanamide
CID 43107780
(2S)-2-phenoxy-N-(pyridin-4-ylmethyl)propanamide
CID 670240
(2S)-N-(pyridin-4-ylmethyl)-2-[2-(trifluoromethyl)benzimidazol-1-yl]propanamide
CID 1485402
2-(4-amino-3-methylpyrazol-1-yl)-N-ethylpropanamide
CID 165472875
(2S)-2-amino-3,3-dimethyl-N-(pyridin-4-ylmethyl)butanamide
CID 61148496

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide?
The IUPAC name of 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide (CID 56686272) is 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide.
What is the SMILES notation for 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide?
The canonical SMILES for 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide is Cc1nn(C)c2cn(C(C)C(=O)NCc3ccncc3)nc12.
What is the InChIKey of 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide?
The InChIKey is JPAMSAKHUHJIOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N6O/c1-10-14-13(20(3)18-10)9-21(19-14)11(2)15(22)17-8-12-4-6-16-7-5-12/h4-7,9,11H,8H2,1-3H3,(H,17,22).
What are the key properties of 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide?
2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide has a molecular weight of 298.35 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dimethylpyrazolo[4,3-c]pyrazol-5-yl)-N-(pyridin-4-ylmethyl)propanamide is sourced from PubChem (CID 56686272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).