(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

C15H20N2O2 — CID 63523014

IUPAC(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCC1Cc2ccccc2N(C(=O)C2CC(O)CN2)C1
InChIInChI=1S/C15H20N2O2/c1-10-6-11-4-2-3-5-14(11)17(9-10)15(19)13-7-12(18)8-16-13/h2-5,10,12-13,16,18H,6-9H2,1H3
InChIKeyHZSWPGDAAQMFST-UHFFFAOYSA-N
MW260.34 g/mol
LogP0.93
Rot. Bonds1

About (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone

(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (PubChem CID 63523014) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.

Molecular Properties

Compound Name(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
PubChem CID63523014
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
SMILESCC1Cc2ccccc2N(C(=O)C2CC(O)CN2)C1
InChIInChI=1S/C15H20N2O2/c1-10-6-11-4-2-3-5-14(11)17(9-10)15(19)13-7-12(18)8-16-13/h2-5,10,12-13,16,18H,6-9H2,1H3
InChIKeyHZSWPGDAAQMFST-UHFFFAOYSA-N
XLogP0.93
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(5-methylpiperazin-2-yl)methanone
CID 63526190
(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-piperidin-2-ylmethanone
CID 63522655
(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-(6-methylpiperidin-2-yl)methanone
CID 63526013
4-(3-methyl-3,4-dihydro-2H-quinoline-1-carbonyl)pyrrolidin-2-one
CID 78942007
(3-methyl-3,4-dihydro-2H-quinolin-1-yl)-morpholin-2-ylmethanone
CID 63522121
4-hydroxy-N-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]pyrrolidine-2-carboxamide
CID 119868403
N-tert-butyl-3-methyl-3,4-dihydro-2H-quinoline-1-carboxamide
CID 110662911
3-amino-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 63466515
1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)but-2-yn-1-one
CID 166787570
(1-aminocyclobutyl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 81169109
2-methyl-2-(methylamino)-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 55195653
(2R)-2-amino-1-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)propan-1-one;hydrochloride
CID 119319569

Frequently Asked Questions

What is the IUPAC name of (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The IUPAC name of (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone (CID 63523014) is (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone.
What is the SMILES notation for (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The canonical SMILES for (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is CC1Cc2ccccc2N(C(=O)C2CC(O)CN2)C1.
What is the InChIKey of (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
The InChIKey is HZSWPGDAAQMFST-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10-6-11-4-2-3-5-14(11)17(9-10)15(19)13-7-12(18)8-16-13/h2-5,10,12-13,16,18H,6-9H2,1H3.
What are the key properties of (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone?
(4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone has a molecular weight of 260.34 g/mol, XLogP of 0.93, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxypyrrolidin-2-yl)-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone is sourced from PubChem (CID 63523014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).