3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone

C21H25N3O — CID 109196432

IUPAC3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone
SMILESCC1CCCN(c2ccc(C(=O)N3CCCc4ccccc43)nc2)C1
InChIInChI=1S/C21H25N3O/c1-16-6-4-12-23(15-16)18-10-11-19(22-14-18)21(25)24-13-5-8-17-7-2-3-9-20(17)24/h2-3,7,9-11,14,16H,4-6,8,12-13,15H2,1H3
InChIKeyZVXDHVDETKJLFO-UHFFFAOYSA-N
MW335.45 g/mol
LogP3.91
Rot. Bonds2

About 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone

3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone (PubChem CID 109196432) has the molecular formula C21H25N3O and a molecular weight of 335.45 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone
PubChem CID109196432
Molecular FormulaC21H25N3O
Molecular Weight335.45 g/mol
Exact Mass335.20
IUPAC Name3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone
SMILESCC1CCCN(c2ccc(C(=O)N3CCCc4ccccc43)nc2)C1
InChIInChI=1S/C21H25N3O/c1-16-6-4-12-23(15-16)18-10-11-19(22-14-18)21(25)24-13-5-8-17-7-2-3-9-20(17)24/h2-3,7,9-11,14,16H,4-6,8,12-13,15H2,1H3
InChIKeyZVXDHVDETKJLFO-UHFFFAOYSA-N
XLogP3.91
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone with MolForge

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Related Compounds

[5-(azepan-1-yl)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109196863
ethyl 4-[6-(3,4-dihydro-2H-quinoline-1-carbonyl)-3-pyridinyl]piperazine-1-carboxylate
CID 109194191
4-[5-(3-methylpiperidin-1-yl)pyridine-2-carbonyl]piperazine-1-carbaldehyde
CID 109186964
[5-(cyclopropylamino)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109180125
3,4-dihydro-2H-quinolin-1-yl-[5-(propan-2-ylamino)-2-pyridinyl]methanone
CID 109179730
1-(3,4-dihydro-2H-quinolin-1-yl)-2-(3-methylpiperidin-1-yl)ethane-1,2-dione
CID 108505638
3,4-dihydro-2H-quinolin-1-yl-[2-(4-methylpiperidin-1-yl)pyrimidin-5-yl]methanone
CID 109250910
(2-methyl-2,3-dihydroindol-1-yl)-(5-piperidin-1-yl-2-pyridinyl)methanone
CID 109182883
2,3-dihydroindol-1-yl-[5-(2-methyl-2,3-dihydroindol-1-yl)-2-pyridinyl]methanone
CID 109197791
[5-[4-(2-methoxyphenyl)piperazin-1-yl]-2-pyridinyl]-(3-methylpiperidin-1-yl)methanone
CID 109194295
methyl 6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-3-carboxylate
CID 31676778
(5-anilino-2-pyridinyl)-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109197060

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone (CID 109196432) is 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone is CC1CCCN(c2ccc(C(=O)N3CCCc4ccccc43)nc2)C1.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone?
The InChIKey is ZVXDHVDETKJLFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O/c1-16-6-4-12-23(15-16)18-10-11-19(22-14-18)21(25)24-13-5-8-17-7-2-3-9-20(17)24/h2-3,7,9-11,14,16H,4-6,8,12-13,15H2,1H3.
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone?
3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone has a molecular weight of 335.45 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl-[5-(3-methylpiperidin-1-yl)-2-pyridinyl]methanone is sourced from PubChem (CID 109196432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).