1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol

C18H22N4O2 — CID 151287061

IUPAC1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol
SMILESCc1ncccc1-c1cc(N2CCOCC2)nc(N2CC(O)C2)c1
InChIInChI=1S/C18H22N4O2/c1-13-16(3-2-4-19-13)14-9-17(21-5-7-24-8-6-21)20-18(10-14)22-11-15(23)12-22/h2-4,9-10,15,23H,5-8,11-12H2,1H3
InChIKeyNZPUBSRZMNRFMD-UHFFFAOYSA-N
MW326.40 g/mol
LogP1.47
Rot. Bonds3

About 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol

1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol (PubChem CID 151287061) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol.

Molecular Properties

Compound Name1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol
PubChem CID151287061
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol
SMILESCc1ncccc1-c1cc(N2CCOCC2)nc(N2CC(O)C2)c1
InChIInChI=1S/C18H22N4O2/c1-13-16(3-2-4-19-13)14-9-17(21-5-7-24-8-6-21)20-18(10-14)22-11-15(23)12-22/h2-4,9-10,15,23H,5-8,11-12H2,1H3
InChIKeyNZPUBSRZMNRFMD-UHFFFAOYSA-N
XLogP1.47
TPSA61.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol?
The IUPAC name of 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol (CID 151287061) is 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol.
What is the SMILES notation for 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol?
The canonical SMILES for 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol is Cc1ncccc1-c1cc(N2CCOCC2)nc(N2CC(O)C2)c1.
What is the InChIKey of 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol?
The InChIKey is NZPUBSRZMNRFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-13-16(3-2-4-19-13)14-9-17(21-5-7-24-8-6-21)20-18(10-14)22-11-15(23)12-22/h2-4,9-10,15,23H,5-8,11-12H2,1H3.
What are the key properties of 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol?
1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol has a molecular weight of 326.40 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-methyl-3-pyridinyl)-6-morpholin-4-yl-2-pyridinyl]azetidin-3-ol is sourced from PubChem (CID 151287061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).