[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone

C18H20N4O — CID 109111976

IUPAC[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccc(N2CCCc3ccccc32)nn1)N1CCCC1
InChIInChI=1S/C18H20N4O/c23-18(21-11-3-4-12-21)15-9-10-17(20-19-15)22-13-5-7-14-6-1-2-8-16(14)22/h1-2,6,8-10H,3-5,7,11-13H2
InChIKeyGFNICDCKUQQRKP-UHFFFAOYSA-N
MW308.38 g/mol
LogP2.80
Rot. Bonds2

About [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone

[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone (PubChem CID 109111976) has the molecular formula C18H20N4O and a molecular weight of 308.38 g/mol. Its IUPAC name is [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
PubChem CID109111976
Molecular FormulaC18H20N4O
Molecular Weight308.38 g/mol
Exact Mass308.16
IUPAC Name[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
SMILESO=C(c1ccc(N2CCCc3ccccc32)nn1)N1CCCC1
InChIInChI=1S/C18H20N4O/c23-18(21-11-3-4-12-21)15-9-10-17(20-19-15)22-13-5-7-14-6-1-2-8-16(14)22/h1-2,6,8-10H,3-5,7,11-13H2
InChIKeyGFNICDCKUQQRKP-UHFFFAOYSA-N
XLogP2.80
TPSA49.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[6-(3,4-dihydro-2H-quinolin-1-yl)pyrimidin-4-yl]-piperidin-1-ylmethanone
CID 109341707
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203703
[4-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-piperidin-1-ylmethanone
CID 109204447
6-(3,4-dihydro-2H-quinolin-1-yl)-N-ethyl-N-phenylpyridazine-3-carboxamide
CID 109127430
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(1,1-dioxothiolan-3-yl)pyridazine-3-carboxamide
CID 109122860
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(pyridin-4-ylmethyl)pyridazine-3-carboxamide
CID 109121417
6-(2,3-dihydroindol-1-yl)-N-propan-2-ylpyridazine-3-carboxamide
CID 109109688
N-(3-acetylphenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridazine-3-carboxamide
CID 109127449
6-(3,4-dihydro-2H-quinolin-1-yl)-N-[(3-methylphenyl)methyl]pyridazine-3-carboxamide
CID 109118401
[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109186328
[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridazin-3-yl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109121757
[5-(3,4-dihydro-2H-quinolin-1-yl)pyrazin-2-yl]-(4-methylpiperidin-1-yl)methanone
CID 109275086

Frequently Asked Questions

What is the IUPAC name of [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone?
The IUPAC name of [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone (CID 109111976) is [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone.
What is the SMILES notation for [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone?
The canonical SMILES for [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone is O=C(c1ccc(N2CCCc3ccccc32)nn1)N1CCCC1.
What is the InChIKey of [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone?
The InChIKey is GFNICDCKUQQRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O/c23-18(21-11-3-4-12-21)15-9-10-17(20-19-15)22-13-5-7-14-6-1-2-8-16(14)22/h1-2,6,8-10H,3-5,7,11-13H2.
What are the key properties of [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone?
[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone has a molecular weight of 308.38 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 109111976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).