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

C23H23N3O — CID 109170004

IUPAC3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone
SMILESCc1ccc(CNc2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1
InChIInChI=1S/C23H23N3O/c1-17-8-10-18(11-9-17)16-25-22-15-20(12-13-24-22)23(27)26-14-4-6-19-5-2-3-7-21(19)26/h2-3,5,7-13,15H,4,6,14,16H2,1H3,(H,24,25)
InChIKeyHBSAVHCVSGNCAF-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.60
Rot. Bonds4

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

3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone (PubChem CID 109170004) has the molecular formula C23H23N3O and a molecular weight of 357.46 g/mol. Its IUPAC name is 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone
PubChem CID109170004
Molecular FormulaC23H23N3O
Molecular Weight357.46 g/mol
Exact Mass357.18
IUPAC Name3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone
SMILESCc1ccc(CNc2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1
InChIInChI=1S/C23H23N3O/c1-17-8-10-18(11-9-17)16-25-22-15-20(12-13-24-22)23(27)26-14-4-6-19-5-2-3-7-21(19)26/h2-3,5,7-13,15H,4,6,14,16H2,1H3,(H,24,25)
InChIKeyHBSAVHCVSGNCAF-UHFFFAOYSA-N
XLogP4.60
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-quinolin-1-yl-[2-(ethylamino)-4-pyridinyl]methanone
CID 62172303
3,4-dihydro-2H-quinolin-1-yl-[6-[(4-methylphenyl)methylamino]pyrimidin-4-yl]methanone
CID 109347315
[2-(3,4-dihydro-2H-quinoline-1-carbonyl)-4-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109091635
2,3-dihydroindol-1-yl-[2-[2-(4-methoxyphenyl)ethylamino]-4-pyridinyl]methanone
CID 109173038
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-ethylphenyl)pyridine-2-carboxamide
CID 109091643
2-[[4-(3,4-dihydro-2H-quinoline-1-carbonyl)-2-pyridinyl]amino]benzonitrile
CID 109176532
4-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(2,4-dimethylphenyl)pyridine-2-carboxamide
CID 109091636
4-(2,3-dihydroindole-1-carbonyl)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109091330
3,4-dihydro-2H-quinolin-1-yl-(3-methylphenyl)methanone
CID 669077
[6-(1,3-benzodioxol-5-ylmethylamino)-3-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109157414
1-[3-(2,3-dihydroindole-1-carbonyl)phenyl]-3-[(4-methylphenyl)methyl]urea
CID 60614335
3,4-dihydro-2H-quinolin-1-yl-[2-[(1,1-dioxothiolan-3-yl)amino]-4-pyridinyl]methanone
CID 109173335

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone?
The IUPAC name of 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone (CID 109170004) is 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone.
What is the SMILES notation for 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone?
The canonical SMILES for 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone is Cc1ccc(CNc2cc(C(=O)N3CCCc4ccccc43)ccn2)cc1.
What is the InChIKey of 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone?
The InChIKey is HBSAVHCVSGNCAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O/c1-17-8-10-18(11-9-17)16-25-22-15-20(12-13-24-22)23(27)26-14-4-6-19-5-2-3-7-21(19)26/h2-3,5,7-13,15H,4,6,14,16H2,1H3,(H,24,25).
What are the key properties of 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone?
3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone has a molecular weight of 357.46 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-quinolin-1-yl-[2-[(4-methylphenyl)methylamino]-4-pyridinyl]methanone is sourced from PubChem (CID 109170004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).