(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone

C20H18ClN3O — CID 17375203

IUPAC(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone
SMILESO=C(c1cc(-c2ccncc2)nc2ccc(Cl)cc12)N1CCCCC1
InChIInChI=1S/C20H18ClN3O/c21-15-4-5-18-16(12-15)17(20(25)24-10-2-1-3-11-24)13-19(23-18)14-6-8-22-9-7-14/h4-9,12-13H,1-3,10-11H2
InChIKeyMTNNWQPPQGNKTJ-UHFFFAOYSA-N
MW351.84 g/mol
LogP4.58
Rot. Bonds2

About (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone

(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone (PubChem CID 17375203) has the molecular formula C20H18ClN3O and a molecular weight of 351.84 g/mol. Its IUPAC name is (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone.

Molecular Properties

Compound Name(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone
PubChem CID17375203
Molecular FormulaC20H18ClN3O
Molecular Weight351.84 g/mol
Exact Mass351.11
IUPAC Name(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone
SMILESO=C(c1cc(-c2ccncc2)nc2ccc(Cl)cc12)N1CCCCC1
InChIInChI=1S/C20H18ClN3O/c21-15-4-5-18-16(12-15)17(20(25)24-10-2-1-3-11-24)13-19(23-18)14-6-8-22-9-7-14/h4-9,12-13H,1-3,10-11H2
InChIKeyMTNNWQPPQGNKTJ-UHFFFAOYSA-N
XLogP4.58
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.84
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-2-pyridin-4-ylquinoline-4-carboxylic acid
CID 3789667
(6-chloro-2-pyridin-4-ylquinolin-4-yl)-[4-(3,4-dichlorophenyl)piperazin-1-yl]methanone
CID 17375214
(6-chloro-2-pyridin-4-ylquinolin-4-yl)-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 2965627
(4-chlorophenyl)-[4-(2-pyridin-4-ylquinoline-4-carbonyl)piperazin-1-yl]methanone
CID 37068160
[2-(4-fluorophenyl)-6-methylquinolin-4-yl]-piperidin-1-ylmethanone
CID 42749728
[2-(4-bromophenyl)-6-methylquinolin-4-yl]-piperidin-1-ylmethanone
CID 17386031
(4-benzylpiperidin-1-yl)-(6-chloro-2-phenylquinolin-4-yl)methanone
CID 17250380
(3-methylphenyl)-[4-(2-pyridin-4-ylquinoline-4-carbonyl)-1,4-diazepan-1-yl]methanone
CID 38462791
piperidin-1-yl-(2-pyridin-3-ylquinolin-4-yl)methanone
CID 25179508
(6-methyl-2-pyridin-4-ylquinolin-4-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone
CID 1261235
(2-pyridin-3-ylquinolin-4-yl)-pyrrolidin-1-ylmethanone
CID 3412131
(3,4-dichlorophenyl)-[1-(2-pyridin-4-ylquinoline-4-carbonyl)piperidin-4-yl]methanone
CID 55955997

Frequently Asked Questions

What is the IUPAC name of (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone?
The IUPAC name of (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone (CID 17375203) is (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone.
What is the SMILES notation for (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone?
The canonical SMILES for (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone is O=C(c1cc(-c2ccncc2)nc2ccc(Cl)cc12)N1CCCCC1.
What is the InChIKey of (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone?
The InChIKey is MTNNWQPPQGNKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClN3O/c21-15-4-5-18-16(12-15)17(20(25)24-10-2-1-3-11-24)13-19(23-18)14-6-8-22-9-7-14/h4-9,12-13H,1-3,10-11H2.
What are the key properties of (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone?
(6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone has a molecular weight of 351.84 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-2-pyridin-4-ylquinolin-4-yl)-piperidin-1-ylmethanone is sourced from PubChem (CID 17375203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).