N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide

C20H17N3O4 — CID 42382062

IUPACN-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1ccco1)c1cc(COc2cccc3cccnc23)on1
InChIInChI=1S/C20H17N3O4/c24-20(22-10-8-15-6-3-11-25-15)17-12-16(27-23-17)13-26-18-7-1-4-14-5-2-9-21-19(14)18/h1-7,9,11-12H,8,10,13H2,(H,22,24)
InChIKeyKPNIOIOFJLNHRW-UHFFFAOYSA-N
MW363.37 g/mol
LogP3.37
Rot. Bonds7

About N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide

N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide (PubChem CID 42382062) has the molecular formula C20H17N3O4 and a molecular weight of 363.37 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
PubChem CID42382062
Molecular FormulaC20H17N3O4
Molecular Weight363.37 g/mol
Exact Mass363.12
IUPAC NameN-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
SMILESO=C(NCCc1ccco1)c1cc(COc2cccc3cccnc23)on1
InChIInChI=1S/C20H17N3O4/c24-20(22-10-8-15-6-3-11-25-15)17-12-16(27-23-17)13-26-18-7-1-4-14-5-2-9-21-19(14)18/h1-7,9,11-12H,8,10,13H2,(H,22,24)
InChIKeyKPNIOIOFJLNHRW-UHFFFAOYSA-N
XLogP3.37
TPSA90.39 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-methylsulfanylethyl)-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 42566769
1-(furan-2-ylmethyl)-3-(2-quinolin-8-yloxyethyl)urea
CID 112975963
5-(furan-2-yl)-N-(4-quinolin-8-yloxybut-2-ynyl)-1,2-oxazole-3-carboxamide
CID 90579599
N-[3-(furan-2-ylmethoxy)propyl]quinoline-8-carboxamide
CID 51296890
methyl 3-[[2-(quinolin-8-yloxymethyl)-1,3-oxazole-4-carbonyl]amino]propanoate
CID 26406157
N-[2-(furan-2-yl)ethyl]pyrazine-2-carboxamide
CID 110745469
N-(furan-2-ylmethyl)-2-quinolin-8-yloxypropanamide
CID 4781245
2-bromo-N-[2-(furan-2-yl)ethyl]pyridine-3-carboxamide
CID 103753929
N-methyl-5-(quinolin-8-yloxymethyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1,2-oxazole-3-carboxamide
CID 45240952
(4-cyclopentylpiperazin-1-yl)-[5-(quinolin-8-yloxymethyl)-1,2-oxazol-3-yl]methanone
CID 42216229
N-[2-(furan-2-yl)ethyl]-5-(methylamino)pyridine-2-carboxamide
CID 113436120
N-[[(2S)-oxolan-2-yl]methyl]-N-propyl-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide
CID 26322660

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide (CID 42382062) is N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide is O=C(NCCc1ccco1)c1cc(COc2cccc3cccnc23)on1.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide?
The InChIKey is KPNIOIOFJLNHRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O4/c24-20(22-10-8-15-6-3-11-25-15)17-12-16(27-23-17)13-26-18-7-1-4-14-5-2-9-21-19(14)18/h1-7,9,11-12H,8,10,13H2,(H,22,24).
What are the key properties of N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide?
N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide has a molecular weight of 363.37 g/mol, XLogP of 3.37, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-5-(quinolin-8-yloxymethyl)-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 42382062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).