(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone

C24H28N2O2 — CID 112822377

IUPAC(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCC(C)c1ccc2c(c1)CCCN2C(=O)C1CCCN1C(=O)c1ccccc1
InChIInChI=1S/C24H28N2O2/c1-17(2)19-12-13-21-20(16-19)10-6-14-25(21)24(28)22-11-7-15-26(22)23(27)18-8-4-3-5-9-18/h3-5,8-9,12-13,16-17,22H,6-7,10-11,14-15H2,1-2H3
InChIKeyDLSNJWGOQWEYEA-UHFFFAOYSA-N
MW376.50 g/mol
LogP4.39
Rot. Bonds3

About (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone

(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone (PubChem CID 112822377) has the molecular formula C24H28N2O2 and a molecular weight of 376.50 g/mol. Its IUPAC name is (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone.

Molecular Properties

Compound Name(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone
PubChem CID112822377
Molecular FormulaC24H28N2O2
Molecular Weight376.50 g/mol
Exact Mass376.22
IUPAC Name(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCC(C)c1ccc2c(c1)CCCN2C(=O)C1CCCN1C(=O)c1ccccc1
InChIInChI=1S/C24H28N2O2/c1-17(2)19-12-13-21-20(16-19)10-6-14-25(21)24(28)22-11-7-15-26(22)23(27)18-8-4-3-5-9-18/h3-5,8-9,12-13,16-17,22H,6-7,10-11,14-15H2,1-2H3
InChIKeyDLSNJWGOQWEYEA-UHFFFAOYSA-N
XLogP4.39
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.50
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)-[(2S)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]methanone
CID 55940972
methyl 1-[(2S)-1-(thiophene-2-carbonyl)pyrrolidine-2-carbonyl]-2,3-dihydroindole-5-carboxylate
CID 55941427
1-propan-2-yl-3-[3-(6-propan-2-yl-3,4-dihydro-2H-quinoline-1-carbonyl)phenyl]urea
CID 52724176
1-[4-(6-propan-2-yl-3,4-dihydro-2H-quinoline-1-carbonyl)piperidin-1-yl]butan-1-one
CID 87025069
1-[2-(3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-1-yl]butan-1-one
CID 87023568
2-(cyclopropylmethylamino)-1-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 119718812
(1-benzoylpiperidin-2-yl)-(2,3-dihydropyrrolo[3,2-b]pyridin-1-yl)methanone
CID 136516324
(5-cyclopropyl-1H-pyrazol-3-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 60557536
[(2S)-1-(furan-2-carbonyl)pyrrolidin-2-yl]-[6-(trifluoromethoxy)-3,4-dihydro-2H-quinolin-1-yl]methanone
CID 51942560
N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-1-(3,5-dichlorobenzoyl)pyrrolidine-2-carboxamide
CID 71685426
(2S)-1-benzoylpyrrolidine-2-carboxylate
CID 6988238
N-ethyl-4-(6-propan-2-yl-3,4-dihydro-2H-quinoline-1-carbonyl)benzenesulfonamide
CID 60557455

Frequently Asked Questions

What is the IUPAC name of (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The IUPAC name of (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone (CID 112822377) is (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone.
What is the SMILES notation for (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The canonical SMILES for (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone is CC(C)c1ccc2c(c1)CCCN2C(=O)C1CCCN1C(=O)c1ccccc1.
What is the InChIKey of (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The InChIKey is DLSNJWGOQWEYEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N2O2/c1-17(2)19-12-13-21-20(16-19)10-6-14-25(21)24(28)22-11-7-15-26(22)23(27)18-8-4-3-5-9-18/h3-5,8-9,12-13,16-17,22H,6-7,10-11,14-15H2,1-2H3.
What are the key properties of (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone?
(1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone has a molecular weight of 376.50 g/mol, XLogP of 4.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-benzoylpyrrolidin-2-yl)-(6-propan-2-yl-3,4-dihydro-2H-quinolin-1-yl)methanone is sourced from PubChem (CID 112822377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).