(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate

C10H13N3O3 — CID 175009820

IUPAC(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate
SMILESO=C(O)ON1CCc2cnn(C3CC3)c2C1
InChIInChI=1S/C10H13N3O3/c14-10(15)16-12-4-3-7-5-11-13(8-1-2-8)9(7)6-12/h5,8H,1-4,6H2,(H,14,15)
InChIKeyOZYGBMOEROXUNM-UHFFFAOYSA-N
MW223.23 g/mol
LogP1.19
Rot. Bonds2

About (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate

(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate (PubChem CID 175009820) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate.

Molecular Properties

Compound Name(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate
PubChem CID175009820
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC Name(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate
SMILESO=C(O)ON1CCc2cnn(C3CC3)c2C1
InChIInChI=1S/C10H13N3O3/c14-10(15)16-12-4-3-7-5-11-13(8-1-2-8)9(7)6-12/h5,8H,1-4,6H2,(H,14,15)
InChIKeyOZYGBMOEROXUNM-UHFFFAOYSA-N
XLogP1.19
TPSA67.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl)-[(2-methylpropan-2-yl)oxy]methanol
CID 123874112
tert-butyl 1-cyclopropyl-4,6-dihydropyrrolo[3,4-d]pyrazole-5-carboxylate
CID 90426967
1-cyclopropyl-5-methyl-4,6-dihydropyrrolo[3,4-d]pyrazole
CID 118974332
1-cyclopropyl-5-prop-1-en-2-yl-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine
CID 144740369
tert-butyl 1-(thian-4-yl)-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine-6-carboxylate;tert-butyl 2-(thian-4-yl)-5,7-dihydro-4H-pyrazolo[3,4-c]pyridine-6-carboxylate
CID 158578133
1-cyclopropyl-5-fluoropyrazole-4-carboxylic acid
CID 115013687
1-piperidin-4-yl-4,5,6,7-tetrahydropyrazolo[5,4-c]pyridine
CID 105459588
1-cyclohexyl-4-cyclohexyloxypyrazole-5-carboxylic acid
CID 117233178
tert-butyl 1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,5-c]pyridine-5-carboxylate;tert-butyl 2-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxylate
CID 158182468
1-cyclobutyl-5-methoxypyrazole-4-carboxylic acid
CID 115068986
4-bromo-1-cyclopropyl-6,7-dihydropyrazolo[4,3-c]pyridine-3-carboxylic acid
CID 121416972
1-cyclobutyl-4-methoxypyrazole-5-carboxylic acid
CID 117233148

Frequently Asked Questions

What is the IUPAC name of (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate?
The IUPAC name of (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate (CID 175009820) is (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate.
What is the SMILES notation for (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate?
The canonical SMILES for (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate is O=C(O)ON1CCc2cnn(C3CC3)c2C1.
What is the InChIKey of (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate?
The InChIKey is OZYGBMOEROXUNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c14-10(15)16-12-4-3-7-5-11-13(8-1-2-8)9(7)6-12/h5,8H,1-4,6H2,(H,14,15).
What are the key properties of (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate?
(1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate has a molecular weight of 223.23 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1-cyclopropyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridin-6-yl) hydrogen carbonate is sourced from PubChem (CID 175009820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).