N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide

C18H18N2O2 — CID 18109779

IUPACN-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NCCc3ccco3)c2c1
InChIInChI=1S/C18H18N2O2/c1-12-5-6-17-15(10-12)16(11-13(2)20-17)18(21)19-8-7-14-4-3-9-22-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)
InChIKeyWODDQKQRPHMDSP-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.42
Rot. Bonds4

About N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide

N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide (PubChem CID 18109779) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide
PubChem CID18109779
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide
SMILESCc1ccc2nc(C)cc(C(=O)NCCc3ccco3)c2c1
InChIInChI=1S/C18H18N2O2/c1-12-5-6-17-15(10-12)16(11-13(2)20-17)18(21)19-8-7-14-4-3-9-22-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21)
InChIKeyWODDQKQRPHMDSP-UHFFFAOYSA-N
XLogP3.42
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(furan-2-yl)ethyl]-1,3,7-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-5-carboxamide
CID 53085396
2,6-dimethyl-N-[3-(1,2,4-triazol-4-yl)propyl]quinoline-4-carboxamide
CID 70776674
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2,6-dimethylquinoline-4-carboxamide
CID 18161323
2,6-dimethyl-N-[(3-methylphenyl)methyl]quinoline-4-carboxamide
CID 34167121
N-[2-(furan-2-yl)ethyl]-5-methyl-2-(propylamino)benzamide
CID 62510582
N-[2-(furan-2-yl)ethyl]-4-methylbenzamide
CID 5305680
N-[3-(furan-2-yl)propyl]-2,5-dimethylbenzamide
CID 100623229
2-(4-acetamidophenyl)-N-[2-(furan-2-yl)ethyl]quinoline-4-carboxamide
CID 46375317
methyl 6-[(2,6-dimethylquinoline-4-carbonyl)amino]hexanoate
CID 31838218
N-[2-(furan-2-yl)ethyl]-2-(3-hydroxyprop-1-ynyl)-5-methylbenzamide
CID 81112689
2-(furan-2-yl)-6-methyl-N-(2-pyrrolidin-1-ylethyl)quinoline-4-carboxamide
CID 42749836
2,6-dimethyl-N-(pyridin-2-ylmethyl)quinoline-4-carboxamide
CID 18107562

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide (CID 18109779) is N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide is Cc1ccc2nc(C)cc(C(=O)NCCc3ccco3)c2c1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide?
The InChIKey is WODDQKQRPHMDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-5-6-17-15(10-12)16(11-13(2)20-17)18(21)19-8-7-14-4-3-9-22-14/h3-6,9-11H,7-8H2,1-2H3,(H,19,21).
What are the key properties of N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide?
N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 3.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-2,6-dimethylquinoline-4-carboxamide is sourced from PubChem (CID 18109779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).