N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide

C22H25N3O2 — CID 133401169

IUPACN-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide
SMILESCCc1cc(N2CCC(NC(=O)c3ccoc3C)CC2)c2ccccc2n1
InChIInChI=1S/C22H25N3O2/c1-3-16-14-21(19-6-4-5-7-20(19)23-16)25-11-8-17(9-12-25)24-22(26)18-10-13-27-15(18)2/h4-7,10,13-14,17H,3,8-9,11-12H2,1-2H3,(H,24,26)
InChIKeyAEKDERBPRJFGGF-UHFFFAOYSA-N
MW363.46 g/mol
LogP4.10
Rot. Bonds4

About N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide

N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide (PubChem CID 133401169) has the molecular formula C22H25N3O2 and a molecular weight of 363.46 g/mol. Its IUPAC name is N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide
PubChem CID133401169
Molecular FormulaC22H25N3O2
Molecular Weight363.46 g/mol
Exact Mass363.19
IUPAC NameN-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide
SMILESCCc1cc(N2CCC(NC(=O)c3ccoc3C)CC2)c2ccccc2n1
InChIInChI=1S/C22H25N3O2/c1-3-16-14-21(19-6-4-5-7-20(19)23-16)25-11-8-17(9-12-25)24-22(26)18-10-13-27-15(18)2/h4-7,10,13-14,17H,3,8-9,11-12H2,1-2H3,(H,24,26)
InChIKeyAEKDERBPRJFGGF-UHFFFAOYSA-N
XLogP4.10
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide 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

tert-butyl N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]carbamate
CID 133400609
6-[4-[(2-methylfuran-3-carbonyl)amino]piperidin-1-yl]pyridine-2-carboxylic acid
CID 122053563
2-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-1-pyrrolidin-1-ylethanone
CID 133400414
ethyl 2-[4-[(2-methylfuran-3-carbonyl)amino]piperidin-1-yl]pyridine-3-carboxylate
CID 133469987
2-ethyl-4-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)quinoline
CID 133402710
N-[1-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperidin-4-yl]-2-methylfuran-3-carboxamide
CID 133287347
N-[1-(7-chloroquinazolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide
CID 86884110
N-[1-(5-bromo-3-methyl-2-pyridinyl)piperidin-4-yl]-2-methylfuran-3-carboxamide
CID 133361207
4-(2-ethylquinolin-4-yl)thiomorpholine
CID 133400472
2-methyl-N-[1-(8-nitroisoquinolin-5-yl)piperidin-4-yl]furan-3-carboxamide
CID 133287364
N-[1-(3-amino-2-methyl-3-phenylpropanoyl)piperidin-4-yl]-2-methylfuran-3-carboxamide;hydrochloride
CID 119771791
2-methyl-N-[1-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]piperidin-4-yl]furan-3-carboxamide
CID 136522965

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide?
The IUPAC name of N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide (CID 133401169) is N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide.
What is the SMILES notation for N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide?
The canonical SMILES for N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide is CCc1cc(N2CCC(NC(=O)c3ccoc3C)CC2)c2ccccc2n1.
What is the InChIKey of N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide?
The InChIKey is AEKDERBPRJFGGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O2/c1-3-16-14-21(19-6-4-5-7-20(19)23-16)25-11-8-17(9-12-25)24-22(26)18-10-13-27-15(18)2/h4-7,10,13-14,17H,3,8-9,11-12H2,1-2H3,(H,24,26).
What are the key properties of N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide?
N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 4.10, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-ethylquinolin-4-yl)piperidin-4-yl]-2-methylfuran-3-carboxamide is sourced from PubChem (CID 133401169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).