1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide

C22H23N3O2 — CID 10594748

IUPAC1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide
SMILESCOc1ccccc1-c1cc(N2CCC(C(N)=O)CC2)c2ccccc2n1
InChIInChI=1S/C22H23N3O2/c1-27-21-9-5-3-7-17(21)19-14-20(16-6-2-4-8-18(16)24-19)25-12-10-15(11-13-25)22(23)26/h2-9,14-15H,10-13H2,1H3,(H2,23,26)
InChIKeyOEZNFYKNLJTEBD-UHFFFAOYSA-N
MW361.45 g/mol
LogP3.61
Rot. Bonds4

About 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide

1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide (PubChem CID 10594748) has the molecular formula C22H23N3O2 and a molecular weight of 361.45 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide
PubChem CID10594748
Molecular FormulaC22H23N3O2
Molecular Weight361.45 g/mol
Exact Mass361.18
IUPAC Name1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide
SMILESCOc1ccccc1-c1cc(N2CCC(C(N)=O)CC2)c2ccccc2n1
InChIInChI=1S/C22H23N3O2/c1-27-21-9-5-3-7-17(21)19-14-20(16-6-2-4-8-18(16)24-19)25-12-10-15(11-13-25)22(23)26/h2-9,14-15H,10-13H2,1H3,(H2,23,26)
InChIKeyOEZNFYKNLJTEBD-UHFFFAOYSA-N
XLogP3.61
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.45
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[4-(2-methoxyphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 46907682
1-[2-[4-(2-ethoxyphenyl)phenyl]quinolin-4-yl]piperidine-4-carboxylic acid
CID 143206525
1-[2-[4-(2-propan-2-yloxyphenyl)phenyl]quinolin-4-yl]piperidine-4-carboxylic acid
CID 143206570
1-(8-chloro-2-phenylquinolin-4-yl)piperidine-4-carboxamide
CID 70458572
ethyl 1-[2-(4-bromophenyl)quinolin-4-yl]piperidine-4-carboxylate
CID 143206576
1-(8-fluoro-2-phenylquinolin-4-yl)piperidine-4-carboxamide
CID 70458673
methyl 1-(2-methylquinolin-4-yl)pyrrolidine-3-carboxylate
CID 78983917
2-(4-methoxyphenyl)-4-pyrrolidin-1-ylquinoline
CID 45051409
1-(2-amino-4-fluoro-5-methoxyphenyl)piperidine-4-carboxamide
CID 55215681
1-[4-(dimethylamino)quinazolin-2-yl]piperidine-4-carboxamide;hydrochloride
CID 52995764
1-[2-(2-fluorophenyl)quinazolin-4-yl]piperidine-4-carboxamide
CID 4523705
N-(3,4-dimethoxyphenyl)-1-[6-(2-methoxyphenyl)pyridazin-3-yl]piperidine-4-carboxamide
CID 30363123

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide (CID 10594748) is 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide is COc1ccccc1-c1cc(N2CCC(C(N)=O)CC2)c2ccccc2n1.
What is the InChIKey of 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide?
The InChIKey is OEZNFYKNLJTEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N3O2/c1-27-21-9-5-3-7-17(21)19-14-20(16-6-2-4-8-18(16)24-19)25-12-10-15(11-13-25)22(23)26/h2-9,14-15H,10-13H2,1H3,(H2,23,26).
What are the key properties of 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide?
1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide has a molecular weight of 361.45 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenyl)quinolin-4-yl]piperidine-4-carboxamide is sourced from PubChem (CID 10594748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).