(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

C23H22N2O2 — CID 13279134

IUPAC(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCCc1ccc2c(c1)c(OC)c(CC)c1nc(C(=O)c3ccccc3)cn12
InChIInChI=1S/C23H22N2O2/c1-4-15-11-12-20-18(13-15)22(27-3)17(5-2)23-24-19(14-25(20)23)21(26)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3
InChIKeyPRNVNHOPFKQPSW-UHFFFAOYSA-N
MW358.44 g/mol
LogP4.85
Rot. Bonds5

About (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (PubChem CID 13279134) has the molecular formula C23H22N2O2 and a molecular weight of 358.44 g/mol. Its IUPAC name is (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
PubChem CID13279134
Molecular FormulaC23H22N2O2
Molecular Weight358.44 g/mol
Exact Mass358.17
IUPAC Name(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCCc1ccc2c(c1)c(OC)c(CC)c1nc(C(=O)c3ccccc3)cn12
InChIInChI=1S/C23H22N2O2/c1-4-15-11-12-20-18(13-15)22(27-3)17(5-2)23-24-19(14-25(20)23)21(26)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3
InChIKeyPRNVNHOPFKQPSW-UHFFFAOYSA-N
XLogP4.85
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 54.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The IUPAC name of (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (CID 13279134) is (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.
What is the SMILES notation for (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The canonical SMILES for (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is CCc1ccc2c(c1)c(OC)c(CC)c1nc(C(=O)c3ccccc3)cn12.
What is the InChIKey of (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The InChIKey is PRNVNHOPFKQPSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22N2O2/c1-4-15-11-12-20-18(13-15)22(27-3)17(5-2)23-24-19(14-25(20)23)21(26)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3.
What are the key properties of (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
(4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone has a molecular weight of 358.44 g/mol, XLogP of 4.85, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4,7-diethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is sourced from PubChem (CID 13279134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).