N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

C22H29N5O2 — CID 26232104

IUPACN-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccccn1)C2
InChIInChI=1S/C22H29N5O2/c1-15(2)13-27-19-10-12-26(22(29)18-9-5-6-11-23-18)14-17(19)20(25-27)21(28)24-16-7-3-4-8-16/h5-6,9,11,15-16H,3-4,7-8,10,12-14H2,1-2H3,(H,24,28)
InChIKeyIGTWRYIMKZKRBM-UHFFFAOYSA-N
MW395.51 g/mol
LogP2.81
Rot. Bonds5

About N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide

N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (PubChem CID 26232104) has the molecular formula C22H29N5O2 and a molecular weight of 395.51 g/mol. Its IUPAC name is N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
PubChem CID26232104
Molecular FormulaC22H29N5O2
Molecular Weight395.51 g/mol
Exact Mass395.23
IUPAC NameN-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
SMILESCC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccccn1)C2
InChIInChI=1S/C22H29N5O2/c1-15(2)13-27-19-10-12-26(22(29)18-9-5-6-11-23-18)14-17(19)20(25-27)21(28)24-16-7-3-4-8-16/h5-6,9,11,15-16H,3-4,7-8,10,12-14H2,1-2H3,(H,24,28)
InChIKeyIGTWRYIMKZKRBM-UHFFFAOYSA-N
XLogP2.81
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.51
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide (CID 26232104) is N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is CC(C)Cn1nc(C(=O)NC2CCCC2)c2c1CCN(C(=O)c1ccccn1)C2.
What is the InChIKey of N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
The InChIKey is IGTWRYIMKZKRBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N5O2/c1-15(2)13-27-19-10-12-26(22(29)18-9-5-6-11-23-18)14-17(19)20(25-27)21(28)24-16-7-3-4-8-16/h5-6,9,11,15-16H,3-4,7-8,10,12-14H2,1-2H3,(H,24,28).
What are the key properties of N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide?
N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide has a molecular weight of 395.51 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(2-methylpropyl)-5-(pyridine-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide is sourced from PubChem (CID 26232104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).