(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

C15H22N4O2 — CID 163276641

IUPAC(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
SMILESC[C@@H]1NC(=O)c2cc(N3CCOC[C@H]3C)nn2[C@@H]1C1CC1
InChIInChI=1S/C15H22N4O2/c1-9-8-21-6-5-18(9)13-7-12-15(20)16-10(2)14(11-3-4-11)19(12)17-13/h7,9-11,14H,3-6,8H2,1-2H3,(H,16,20)/t9-,10+,14+/m1/s1
InChIKeyNUYGXECMOMXYHE-BFVZDQMLSA-N
MW290.37 g/mol
LogP1.19
Rot. Bonds2

About (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one

(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one (PubChem CID 163276641) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one.

Molecular Properties

Compound Name(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
PubChem CID163276641
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
SMILESC[C@@H]1NC(=O)c2cc(N3CCOC[C@H]3C)nn2[C@@H]1C1CC1
InChIInChI=1S/C15H22N4O2/c1-9-8-21-6-5-18(9)13-7-12-15(20)16-10(2)14(11-3-4-11)19(12)17-13/h7,9-11,14H,3-6,8H2,1-2H3,(H,16,20)/t9-,10+,14+/m1/s1
InChIKeyNUYGXECMOMXYHE-BFVZDQMLSA-N
XLogP1.19
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(R)-7-isopropyl-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 157049303
Vps34-IN-3
CID 157049304
(7R)-7-cyclopropyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 163276606
(R)-7'-cyclopropyl-2'-((R)-3-methylmorpholino)-7'H-spiro[cyclopropane-1,6'-pyrazolo[1,5-a]pyrazin]-4'(5'H)-one
CID 163276635
(S)-7-(2-hydroxypropan-2-yl)-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276666
(S)-2-((R)-3-methylmorpholino)-7-(trifluoromethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276679
(R)-2-((R)-3-methylmorpholino)-6-(trifluoromethyl)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276686
(6S,7R)-6,7-dicyclopropyl-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276692
(R)-7-(tert-butyl)-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276696
(R)-7-cyclobutyl-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276705
(R)-7-cyclopentyl-2-((R)-3-methylmorpholino)-6,7-dihydropyrazolo[1,5-a]pyrazin-4(5H)-one
CID 163276709
(7R)-2-morpholin-4-yl-7-propan-2-yl-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one
CID 168273898

Frequently Asked Questions

What is the IUPAC name of (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one?
The IUPAC name of (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one (CID 163276641) is (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one.
What is the SMILES notation for (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one?
The canonical SMILES for (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one is C[C@@H]1NC(=O)c2cc(N3CCOC[C@H]3C)nn2[C@@H]1C1CC1.
What is the InChIKey of (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one?
The InChIKey is NUYGXECMOMXYHE-BFVZDQMLSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-9-8-21-6-5-18(9)13-7-12-15(20)16-10(2)14(11-3-4-11)19(12)17-13/h7,9-11,14H,3-6,8H2,1-2H3,(H,16,20)/t9-,10+,14+/m1/s1.
What are the key properties of (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one?
(6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one has a molecular weight of 290.37 g/mol, XLogP of 1.19, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6S,7R)-7-cyclopropyl-6-methyl-2-[(3R)-3-methylmorpholin-4-yl]-6,7-dihydro-5H-pyrazolo[1,5-a]pyrazin-4-one is sourced from PubChem (CID 163276641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).