N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide

C18H19N3O2 — CID 51162742

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide
SMILESCN(C)C(CNC(=O)c1ccc2ccccc2n1)c1ccco1
InChIInChI=1S/C18H19N3O2/c1-21(2)16(17-8-5-11-23-17)12-19-18(22)15-10-9-13-6-3-4-7-14(13)20-15/h3-11,16H,12H2,1-2H3,(H,19,22)
InChIKeyAKQUEGSLKZDMKH-UHFFFAOYSA-N
MW309.37 g/mol
LogP2.86
Rot. Bonds5

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide (PubChem CID 51162742) has the molecular formula C18H19N3O2 and a molecular weight of 309.37 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide
PubChem CID51162742
Molecular FormulaC18H19N3O2
Molecular Weight309.37 g/mol
Exact Mass309.15
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide
SMILESCN(C)C(CNC(=O)c1ccc2ccccc2n1)c1ccco1
InChIInChI=1S/C18H19N3O2/c1-21(2)16(17-8-5-11-23-17)12-19-18(22)15-10-9-13-6-3-4-7-14(13)20-15/h3-11,16H,12H2,1-2H3,(H,19,22)
InChIKeyAKQUEGSLKZDMKH-UHFFFAOYSA-N
XLogP2.86
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.37
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Dibucaine
CID 3025
Dibucaine Hydrochloride
CID 521951
2-(5-methylfuran-2-yl)-N-(4-methylphenyl)quinoline-4-carboxamide
CID 868700
N-(furan-2-ylmethyl)quinoxaline-6-carboxamide
CID 2978966
(5-(1-isopropylpiperidin-4-yloxy)-1H-indol-2-yl)(morpholino)methanone
CID 11717680
(1H-Indol-2-yl)(4-(2-(4-methoxyphenoxy)ethyl)piperazin-1-yl)methanone
CID 27842480
2-(furan-2-yl)-N-(4-methoxyphenyl)quinoline-4-carboxamide
CID 903397
Ethyl 4-(furan-2-ylmethylamino)quinoline-3-carboxylate
CID 709114
1-(2,6-dimethyl-1H-indol-3-yl)-2-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone
CID 1932249
N-[2-(4-methoxyphenyl)ethyl]quinoline-2-carboxamide
CID 2093012
Methyl 1-(2-(furan-2-yl)quinoline-4-carbonyl)piperidine-4-carboxylate
CID 2420130
Cinchoninamide, 2-butoxy-N-(2-(1-pyrrolidinyl)ethyl)-
CID 3051612

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide (CID 51162742) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide is CN(C)C(CNC(=O)c1ccc2ccccc2n1)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide?
The InChIKey is AKQUEGSLKZDMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-21(2)16(17-8-5-11-23-17)12-19-18(22)15-10-9-13-6-3-4-7-14(13)20-15/h3-11,16H,12H2,1-2H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide has a molecular weight of 309.37 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]quinoline-2-carboxamide is sourced from PubChem (CID 51162742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).