[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone

C25H24N4O3 — CID 71797858

IUPAC[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESCCOc1ccc2ccccc2c1C(=O)N1CCN(C(=O)c2cnn3ccccc23)CC1
InChIInChI=1S/C25H24N4O3/c1-2-32-22-11-10-18-7-3-4-8-19(18)23(22)25(31)28-15-13-27(14-16-28)24(30)20-17-26-29-12-6-5-9-21(20)29/h3-12,17H,2,13-16H2,1H3
InChIKeyGKCPRFNNLQBPCG-UHFFFAOYSA-N
MW428.49 g/mol
LogP3.48
Rot. Bonds4

About [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone

[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone (PubChem CID 71797858) has the molecular formula C25H24N4O3 and a molecular weight of 428.49 g/mol. Its IUPAC name is [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone.

Molecular Properties

Compound Name[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
PubChem CID71797858
Molecular FormulaC25H24N4O3
Molecular Weight428.49 g/mol
Exact Mass428.18
IUPAC Name[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESCCOc1ccc2ccccc2c1C(=O)N1CCN(C(=O)c2cnn3ccccc23)CC1
InChIInChI=1S/C25H24N4O3/c1-2-32-22-11-10-18-7-3-4-8-19(18)23(22)25(31)28-15-13-27(14-16-28)24(30)20-17-26-29-12-6-5-9-21(20)29/h3-12,17H,2,13-16H2,1H3
InChIKeyGKCPRFNNLQBPCG-UHFFFAOYSA-N
XLogP3.48
TPSA67.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.49
LogP ≤ 53.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The IUPAC name of [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone (CID 71797858) is [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone.
What is the SMILES notation for [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The canonical SMILES for [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone is CCOc1ccc2ccccc2c1C(=O)N1CCN(C(=O)c2cnn3ccccc23)CC1.
What is the InChIKey of [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The InChIKey is GKCPRFNNLQBPCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O3/c1-2-32-22-11-10-18-7-3-4-8-19(18)23(22)25(31)28-15-13-27(14-16-28)24(30)20-17-26-29-12-6-5-9-21(20)29/h3-12,17H,2,13-16H2,1H3.
What are the key properties of [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone?
[4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone has a molecular weight of 428.49 g/mol, XLogP of 3.48, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-ethoxynaphthalene-1-carbonyl)piperazin-1-yl]-pyrazolo[1,5-a]pyridin-3-ylmethanone is sourced from PubChem (CID 71797858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).