(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone

C18H23N5O2 — CID 56743407

IUPAC(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone
SMILESO=C(c1ccc(-c2cn[nH]c2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C18H23N5O2/c24-18(14-1-2-17(19-11-14)15-12-20-21-13-15)23-5-3-16(4-6-23)22-7-9-25-10-8-22/h1-2,11-13,16H,3-10H2,(H,20,21)
InChIKeyBOFMJCDWTIGMMI-UHFFFAOYSA-N
MW341.41 g/mol
LogP1.41
Rot. Bonds3

About (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone

(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone (PubChem CID 56743407) has the molecular formula C18H23N5O2 and a molecular weight of 341.41 g/mol. Its IUPAC name is (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone.

Molecular Properties

Compound Name(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone
PubChem CID56743407
Molecular FormulaC18H23N5O2
Molecular Weight341.41 g/mol
Exact Mass341.19
IUPAC Name(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone
SMILESO=C(c1ccc(-c2cn[nH]c2)nc1)N1CCC(N2CCOCC2)CC1
InChIInChI=1S/C18H23N5O2/c24-18(14-1-2-17(19-11-14)15-12-20-21-13-15)23-5-3-16(4-6-23)22-7-9-25-10-8-22/h1-2,11-13,16H,3-10H2,(H,20,21)
InChIKeyBOFMJCDWTIGMMI-UHFFFAOYSA-N
XLogP1.41
TPSA74.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone?
The IUPAC name of (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone (CID 56743407) is (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone.
What is the SMILES notation for (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone?
The canonical SMILES for (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone is O=C(c1ccc(-c2cn[nH]c2)nc1)N1CCC(N2CCOCC2)CC1.
What is the InChIKey of (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone?
The InChIKey is BOFMJCDWTIGMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c24-18(14-1-2-17(19-11-14)15-12-20-21-13-15)23-5-3-16(4-6-23)22-7-9-25-10-8-22/h1-2,11-13,16H,3-10H2,(H,20,21).
What are the key properties of (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone?
(4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone has a molecular weight of 341.41 g/mol, XLogP of 1.41, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-morpholin-4-ylpiperidin-1-yl)-[6-(1H-pyrazol-4-yl)-3-pyridinyl]methanone is sourced from PubChem (CID 56743407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).