(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

C18H24N4O — CID 6619939

IUPAC(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESO=C(c1cnn2ccccc12)N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C18H24N4O/c23-18(16-14-19-22-9-5-4-8-17(16)22)21-12-10-20(11-13-21)15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2
InChIKeyLTHXSLFUXIYRPX-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.42
Rot. Bonds2

About (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone

(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone (PubChem CID 6619939) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone.

Molecular Properties

Compound Name(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
PubChem CID6619939
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone
SMILESO=C(c1cnn2ccccc12)N1CCN(C2CCCCC2)CC1
InChIInChI=1S/C18H24N4O/c23-18(16-14-19-22-9-5-4-8-17(16)22)21-12-10-20(11-13-21)15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2
InChIKeyLTHXSLFUXIYRPX-UHFFFAOYSA-N
XLogP2.42
TPSA40.85 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The IUPAC name of (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone (CID 6619939) is (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone.
What is the SMILES notation for (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The canonical SMILES for (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone is O=C(c1cnn2ccccc12)N1CCN(C2CCCCC2)CC1.
What is the InChIKey of (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
The InChIKey is LTHXSLFUXIYRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c23-18(16-14-19-22-9-5-4-8-17(16)22)21-12-10-20(11-13-21)15-6-2-1-3-7-15/h4-5,8-9,14-15H,1-3,6-7,10-13H2.
What are the key properties of (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone?
(4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone has a molecular weight of 312.42 g/mol, XLogP of 2.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclohexylpiperazin-1-yl)-pyrazolo[1,5-a]pyridin-3-ylmethanone is sourced from PubChem (CID 6619939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).