formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide

C9H14N4O3 — CID 175926714

IUPACformic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide
SMILESCNC(=O)N1CCc2[nH]ncc2C1.O=CO
InChIInChI=1S/C8H12N4O.CH2O2/c1-9-8(13)12-3-2-7-6(5-12)4-10-11-7;2-1-3/h4H,2-3,5H2,1H3,(H,9,13)(H,10,11);1H,(H,2,3)
InChIKeyHCVYKFKDRBSRID-UHFFFAOYSA-N
MW226.24 g/mol
LogP-0.19
Rot. Bonds

About formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide

formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide (PubChem CID 175926714) has the molecular formula C9H14N4O3 and a molecular weight of 226.24 g/mol. Its IUPAC name is formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide.

Molecular Properties

Compound Nameformic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide
PubChem CID175926714
Molecular FormulaC9H14N4O3
Molecular Weight226.24 g/mol
Exact Mass226.11
IUPAC Nameformic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide
SMILESCNC(=O)N1CCc2[nH]ncc2C1.O=CO
InChIInChI=1S/C8H12N4O.CH2O2/c1-9-8(13)12-3-2-7-6(5-12)4-10-11-7;2-1-3/h4H,2-3,5H2,1H3,(H,9,13)(H,10,11);1H,(H,2,3)
InChIKeyHCVYKFKDRBSRID-UHFFFAOYSA-N
XLogP-0.19
TPSA98.32 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 5-0.19
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide?
The IUPAC name of formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide (CID 175926714) is formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide.
What is the SMILES notation for formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide?
The canonical SMILES for formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide is CNC(=O)N1CCc2[nH]ncc2C1.O=CO.
What is the InChIKey of formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide?
The InChIKey is HCVYKFKDRBSRID-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O.CH2O2/c1-9-8(13)12-3-2-7-6(5-12)4-10-11-7;2-1-3/h4H,2-3,5H2,1H3,(H,9,13)(H,10,11);1H,(H,2,3).
What are the key properties of formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide?
formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide has a molecular weight of 226.24 g/mol, XLogP of -0.19, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formic acid;N-methyl-1,4,6,7-tetrahydropyrazolo[4,5-c]pyridine-5-carboxamide is sourced from PubChem (CID 175926714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).