(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one

C20H26N4O2 — CID 95128655

IUPAC(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCOCCn1ccnc1[C@@H]1CC(=O)Nc2c1ccc(N1CCCC1)c2C
InChIInChI=1S/C20H26N4O2/c1-14-17(23-8-3-4-9-23)6-5-15-16(13-18(25)22-19(14)15)20-21-7-10-24(20)11-12-26-2/h5-7,10,16H,3-4,8-9,11-13H2,1-2H3,(H,22,25)/t16-/m1/s1
InChIKeyCHWGMGPDVWEZQY-MRXNPFEDSA-N
MW354.45 g/mol
LogP2.91
Rot. Bonds5

About (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one

(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 95128655) has the molecular formula C20H26N4O2 and a molecular weight of 354.45 g/mol. Its IUPAC name is (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
PubChem CID95128655
Molecular FormulaC20H26N4O2
Molecular Weight354.45 g/mol
Exact Mass354.21
IUPAC Name(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCOCCn1ccnc1[C@@H]1CC(=O)Nc2c1ccc(N1CCCC1)c2C
InChIInChI=1S/C20H26N4O2/c1-14-17(23-8-3-4-9-23)6-5-15-16(13-18(25)22-19(14)15)20-21-7-10-24(20)11-12-26-2/h5-7,10,16H,3-4,8-9,11-13H2,1-2H3,(H,22,25)/t16-/m1/s1
InChIKeyCHWGMGPDVWEZQY-MRXNPFEDSA-N
XLogP2.91
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Launch Full Analysis

Related Compounds

4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
CID 50965454
8-methyl-4-(3-methyl-1,2-oxazol-5-yl)-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
CID 169419497
methyl 4-(8-methyl-2-oxo-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-4-yl)benzoate
CID 169411206
4-(2-fluoro-4-methoxyphenyl)-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one
CID 169416064
ethyl 4-(8-methyl-2-oxo-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-4-yl)-1H-pyrazole-5-carboxylate
CID 50958965
1-(2-methoxyethyl)-2-[(2S)-1-methylpyrrolidin-2-yl]imidazole
CID 168941227
(6S)-6-[1-(2-methoxyethyl)imidazol-2-yl]-5-azaspiro[2.3]hexane
CID 125454365
2-[(2R)-3,3-diethylazetidin-2-yl]-1-(2-methoxyethyl)imidazole
CID 125451880
[(3S)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]-(4-pyrrolidin-1-ylphenyl)methanone
CID 97278548
3-fluoro-2-[(3R)-3-[1-(2-methoxyethyl)imidazol-2-yl]piperidin-1-yl]pyridine
CID 97128849
N-[6-methoxy-2-oxo-4-(1-propylimidazol-2-yl)-3,4-dihydro-1H-quinolin-7-yl]methanesulfonamide
CID 50962689
1-(2-methoxyethyl)-4-[4-[1-(2-methoxyethyl)imidazol-2-yl]piperidine-1-carbonyl]pyrrolidin-2-one
CID 72846613

Frequently Asked Questions

What is the IUPAC name of (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one (CID 95128655) is (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one is COCCn1ccnc1[C@@H]1CC(=O)Nc2c1ccc(N1CCCC1)c2C.
What is the InChIKey of (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is CHWGMGPDVWEZQY-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H26N4O2/c1-14-17(23-8-3-4-9-23)6-5-15-16(13-18(25)22-19(14)15)20-21-7-10-24(20)11-12-26-2/h5-7,10,16H,3-4,8-9,11-13H2,1-2H3,(H,22,25)/t16-/m1/s1.
What are the key properties of (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one?
(4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 354.45 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-[1-(2-methoxyethyl)imidazol-2-yl]-8-methyl-7-pyrrolidin-1-yl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 95128655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).