4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine

C19H27N5O — CID 121406375

IUPAC4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine
SMILESc1c(C2CCCCN2)nn2c(N3CCOCC3)c3c(nc12)CCCC3
InChIInChI=1S/C19H27N5O/c1-2-6-15-14(5-1)19(23-9-11-25-12-10-23)24-18(21-15)13-17(22-24)16-7-3-4-8-20-16/h13,16,20H,1-12H2
InChIKeyACUOXUASBXNLJO-UHFFFAOYSA-N
MW341.46 g/mol
LogP2.26
Rot. Bonds2

About 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine

4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine (PubChem CID 121406375) has the molecular formula C19H27N5O and a molecular weight of 341.46 g/mol. Its IUPAC name is 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine.

Molecular Properties

Compound Name4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine
PubChem CID121406375
Molecular FormulaC19H27N5O
Molecular Weight341.46 g/mol
Exact Mass341.22
IUPAC Name4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine
SMILESc1c(C2CCCCN2)nn2c(N3CCOCC3)c3c(nc12)CCCC3
InChIInChI=1S/C19H27N5O/c1-2-6-15-14(5-1)19(23-9-11-25-12-10-23)24-18(21-15)13-17(22-24)16-7-3-4-8-20-16/h13,16,20H,1-12H2
InChIKeyACUOXUASBXNLJO-UHFFFAOYSA-N
XLogP2.26
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.46
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine?
The IUPAC name of 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine (CID 121406375) is 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine.
What is the SMILES notation for 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine?
The canonical SMILES for 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine is c1c(C2CCCCN2)nn2c(N3CCOCC3)c3c(nc12)CCCC3.
What is the InChIKey of 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine?
The InChIKey is ACUOXUASBXNLJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N5O/c1-2-6-15-14(5-1)19(23-9-11-25-12-10-23)24-18(21-15)13-17(22-24)16-7-3-4-8-20-16/h13,16,20H,1-12H2.
What are the key properties of 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine?
4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine has a molecular weight of 341.46 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-piperidin-2-yl-5,6,7,8-tetrahydropyrazolo[5,1-b]quinazolin-9-yl)morpholine is sourced from PubChem (CID 121406375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).