(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone

C22H20N2O — CID 9206325

IUPAC(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1cc(C(=O)N2CC=C(c3ccccc3)CC2)c2ccccc2n1
InChIInChI=1S/C22H20N2O/c1-16-15-20(19-9-5-6-10-21(19)23-16)22(25)24-13-11-18(12-14-24)17-7-3-2-4-8-17/h2-11,15H,12-14H2,1H3
InChIKeyPWQZJFBQQSIYJG-UHFFFAOYSA-N
MW328.42 g/mol
LogP4.47
Rot. Bonds2

About (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone

(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone (PubChem CID 9206325) has the molecular formula C22H20N2O and a molecular weight of 328.42 g/mol. Its IUPAC name is (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone.

Molecular Properties

Compound Name(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
PubChem CID9206325
Molecular FormulaC22H20N2O
Molecular Weight328.42 g/mol
Exact Mass328.16
IUPAC Name(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone
SMILESCc1cc(C(=O)N2CC=C(c3ccccc3)CC2)c2ccccc2n1
InChIInChI=1S/C22H20N2O/c1-16-15-20(19-9-5-6-10-21(19)23-16)22(25)24-13-11-18(12-14-24)17-7-3-2-4-8-17/h2-11,15H,12-14H2,1H3
InChIKeyPWQZJFBQQSIYJG-UHFFFAOYSA-N
XLogP4.47
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.42
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The IUPAC name of (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone (CID 9206325) is (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone.
What is the SMILES notation for (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The canonical SMILES for (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone is Cc1cc(C(=O)N2CC=C(c3ccccc3)CC2)c2ccccc2n1.
What is the InChIKey of (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone?
The InChIKey is PWQZJFBQQSIYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O/c1-16-15-20(19-9-5-6-10-21(19)23-16)22(25)24-13-11-18(12-14-24)17-7-3-2-4-8-17/h2-11,15H,12-14H2,1H3.
What are the key properties of (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone?
(2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone has a molecular weight of 328.42 g/mol, XLogP of 4.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylquinolin-4-yl)-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methanone is sourced from PubChem (CID 9206325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).