7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one

C21H20N4O2 — CID 57396625

IUPAC7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one
SMILESO=c1cc(N2CCOCC2)nc2n(Cc3cccc4ccccc34)ccn12
InChIInChI=1S/C21H20N4O2/c26-20-14-19(23-10-12-27-13-11-23)22-21-24(8-9-25(20)21)15-17-6-3-5-16-4-1-2-7-18(16)17/h1-9,14H,10-13,15H2
InChIKeyQWHPGKXSNCLNSL-UHFFFAOYSA-N
MW360.42 g/mol
LogP2.53
Rot. Bonds3

About 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one

7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one (PubChem CID 57396625) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one
PubChem CID57396625
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one
SMILESO=c1cc(N2CCOCC2)nc2n(Cc3cccc4ccccc34)ccn12
InChIInChI=1S/C21H20N4O2/c26-20-14-19(23-10-12-27-13-11-23)22-21-24(8-9-25(20)21)15-17-6-3-5-16-4-1-2-7-18(16)17/h1-9,14H,10-13,15H2
InChIKeyQWHPGKXSNCLNSL-UHFFFAOYSA-N
XLogP2.53
TPSA51.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one (CID 57396625) is 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one is O=c1cc(N2CCOCC2)nc2n(Cc3cccc4ccccc34)ccn12.
What is the InChIKey of 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one?
The InChIKey is QWHPGKXSNCLNSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c26-20-14-19(23-10-12-27-13-11-23)22-21-24(8-9-25(20)21)15-17-6-3-5-16-4-1-2-7-18(16)17/h1-9,14H,10-13,15H2.
What are the key properties of 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one?
7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one has a molecular weight of 360.42 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-morpholin-4-yl-1-(naphthalen-1-ylmethyl)imidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 57396625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).