1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide

C26H33N5O3 — CID 50830869

IUPAC1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide
SMILESCn1nc(C(=O)N2CCC(C(=O)NC3CCCC3)CC2)c2c1CCN(C(=O)c1ccccc1)C2
InChIInChI=1S/C26H33N5O3/c1-29-22-13-16-31(25(33)19-7-3-2-4-8-19)17-21(22)23(28-29)26(34)30-14-11-18(12-15-30)24(32)27-20-9-5-6-10-20/h2-4,7-8,18,20H,5-6,9-17H2,1H3,(H,27,32)
InChIKeyUPZYLTMBZHBXRI-UHFFFAOYSA-N
MW463.58 g/mol
LogP2.53
Rot. Bonds4

About 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide

1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide (PubChem CID 50830869) has the molecular formula C26H33N5O3 and a molecular weight of 463.58 g/mol. Its IUPAC name is 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide
PubChem CID50830869
Molecular FormulaC26H33N5O3
Molecular Weight463.58 g/mol
Exact Mass463.26
IUPAC Name1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide
SMILESCn1nc(C(=O)N2CCC(C(=O)NC3CCCC3)CC2)c2c1CCN(C(=O)c1ccccc1)C2
InChIInChI=1S/C26H33N5O3/c1-29-22-13-16-31(25(33)19-7-3-2-4-8-19)17-21(22)23(28-29)26(34)30-14-11-18(12-15-30)24(32)27-20-9-5-6-10-20/h2-4,7-8,18,20H,5-6,9-17H2,1H3,(H,27,32)
InChIKeyUPZYLTMBZHBXRI-UHFFFAOYSA-N
XLogP2.53
TPSA87.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.58
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-prop-2-enylpiperidine-4-carboxamide
CID 50831099
(3S)-N-cyclopropyl-1-[5-(3-fluorobenzoyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-3-carboxamide
CID 93071496
N-cyclopentyl-1-methyl-5-(4-piperidin-1-ylbenzoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26228822
N-(1-benzoylpiperidin-4-yl)cyclopentanecarboxamide
CID 110820191
N-cyclopropyl-1-[1-methyl-5-(thiophene-2-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-3-carboxamide
CID 53018181
N-cyclohexyl-4-[1-methyl-3-(pyrrolidine-1-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]-4-oxobutanamide
CID 53017976
1-[5-(cyclobutanecarbonyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]-N-ethylpiperidine-4-carboxamide
CID 50831077
1-[5-(cyclopropanecarbonyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]-N-phenylpiperidine-3-carboxamide
CID 53018193
N-(2-bromophenyl)-1-methyl-3-(pyrrolidine-1-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide
CID 53066814
(3R)-N-cyclopropyl-1-[1-methyl-5-[2-(3-methylphenyl)acetyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidine-3-carboxamide
CID 95052895
(3R)-1-[5-[2-(4-chlorophenyl)acetyl]-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]-N-cyclopropylpiperidine-3-carboxamide
CID 95052903
[(3S)-1-[5-(4-chlorobenzoyl)-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]piperidin-3-yl]-pyrrolidin-1-ylmethanone
CID 95052842

Frequently Asked Questions

What is the IUPAC name of 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide?
The IUPAC name of 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide (CID 50830869) is 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide?
The canonical SMILES for 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide is Cn1nc(C(=O)N2CCC(C(=O)NC3CCCC3)CC2)c2c1CCN(C(=O)c1ccccc1)C2.
What is the InChIKey of 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide?
The InChIKey is UPZYLTMBZHBXRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5O3/c1-29-22-13-16-31(25(33)19-7-3-2-4-8-19)17-21(22)23(28-29)26(34)30-14-11-18(12-15-30)24(32)27-20-9-5-6-10-20/h2-4,7-8,18,20H,5-6,9-17H2,1H3,(H,27,32).
What are the key properties of 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide?
1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide has a molecular weight of 463.58 g/mol, XLogP of 2.53, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-benzoyl-1-methyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl)-N-cyclopentylpiperidine-4-carboxamide is sourced from PubChem (CID 50830869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).