morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone

C15H22N4O3 — CID 118745578

IUPACmorpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone
SMILESO=C(c1n[nH]c2c1CN(C1CCOC1)CC2)N1CCOCC1
InChIInChI=1S/C15H22N4O3/c20-15(18-4-7-21-8-5-18)14-12-9-19(11-2-6-22-10-11)3-1-13(12)16-17-14/h11H,1-10H2,(H,16,17)
InChIKeyJFMORQHEILVLGS-UHFFFAOYSA-N
MW306.37 g/mol
LogP0.03
Rot. Bonds2

About morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone

morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone (PubChem CID 118745578) has the molecular formula C15H22N4O3 and a molecular weight of 306.37 g/mol. Its IUPAC name is morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone
PubChem CID118745578
Molecular FormulaC15H22N4O3
Molecular Weight306.37 g/mol
Exact Mass306.17
IUPAC Namemorpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone
SMILESO=C(c1n[nH]c2c1CN(C1CCOC1)CC2)N1CCOCC1
InChIInChI=1S/C15H22N4O3/c20-15(18-4-7-21-8-5-18)14-12-9-19(11-2-6-22-10-11)3-1-13(12)16-17-14/h11H,1-10H2,(H,16,17)
InChIKeyJFMORQHEILVLGS-UHFFFAOYSA-N
XLogP0.03
TPSA70.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone?
The IUPAC name of morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone (CID 118745578) is morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone.
What is the SMILES notation for morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone?
The canonical SMILES for morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone is O=C(c1n[nH]c2c1CN(C1CCOC1)CC2)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone?
The InChIKey is JFMORQHEILVLGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3/c20-15(18-4-7-21-8-5-18)14-12-9-19(11-2-6-22-10-11)3-1-13(12)16-17-14/h11H,1-10H2,(H,16,17).
What are the key properties of morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone?
morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone has a molecular weight of 306.37 g/mol, XLogP of 0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[5-(oxolan-3-yl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-3-yl]methanone is sourced from PubChem (CID 118745578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).