[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone

C22H24ClN5O2 — CID 71516227

IUPAC[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1)N1CCOCC1
InChIInChI=1S/C22H24ClN5O2/c23-17-1-3-18(4-2-17)28-20-15-24-8-5-19(20)21(25-28)26-9-6-16(7-10-26)22(29)27-11-13-30-14-12-27/h1-5,8,15-16H,6-7,9-14H2
InChIKeyUQPLRGBMLZFBEM-UHFFFAOYSA-N
MW425.92 g/mol
LogP3.15
Rot. Bonds3

About [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone

[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 71516227) has the molecular formula C22H24ClN5O2 and a molecular weight of 425.92 g/mol. Its IUPAC name is [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID71516227
Molecular FormulaC22H24ClN5O2
Molecular Weight425.92 g/mol
Exact Mass425.16
IUPAC Name[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone
SMILESO=C(C1CCN(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1)N1CCOCC1
InChIInChI=1S/C22H24ClN5O2/c23-17-1-3-18(4-2-17)28-20-15-24-8-5-19(20)21(25-28)26-9-6-16(7-10-26)22(29)27-11-13-30-14-12-27/h1-5,8,15-16H,6-7,9-14H2
InChIKeyUQPLRGBMLZFBEM-UHFFFAOYSA-N
XLogP3.15
TPSA63.49 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.92
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone (CID 71516227) is [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone is O=C(C1CCN(c2nn(-c3ccc(Cl)cc3)c3cnccc23)CC1)N1CCOCC1.
What is the InChIKey of [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is UQPLRGBMLZFBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24ClN5O2/c23-17-1-3-18(4-2-17)28-20-15-24-8-5-19(20)21(25-28)26-9-6-16(7-10-26)22(29)27-11-13-30-14-12-27/h1-5,8,15-16H,6-7,9-14H2.
What are the key properties of [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone?
[1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 425.92 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[1-(4-chlorophenyl)pyrazolo[5,4-c]pyridin-3-yl]piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 71516227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).