N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide

C19H20N2O4 — CID 78833071

IUPACN-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)NCCCOCc3ccco3)ccc2c1
InChIInChI=1S/C19H20N2O4/c1-23-15-6-8-17-14(12-15)5-7-18(21-17)19(22)20-9-3-10-24-13-16-4-2-11-25-16/h2,4-8,11-12H,3,9-10,13H2,1H3,(H,20,22)
InChIKeyZQUULSZWGMQXAB-UHFFFAOYSA-N
MW340.38 g/mol
LogP3.17
Rot. Bonds8

About N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide

N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide (PubChem CID 78833071) has the molecular formula C19H20N2O4 and a molecular weight of 340.38 g/mol. Its IUPAC name is N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide.

Molecular Properties

Compound NameN-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide
PubChem CID78833071
Molecular FormulaC19H20N2O4
Molecular Weight340.38 g/mol
Exact Mass340.14
IUPAC NameN-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide
SMILESCOc1ccc2nc(C(=O)NCCCOCc3ccco3)ccc2c1
InChIInChI=1S/C19H20N2O4/c1-23-15-6-8-17-14(12-15)5-7-18(21-17)19(22)20-9-3-10-24-13-16-4-2-11-25-16/h2,4-8,11-12H,3,9-10,13H2,1H3,(H,20,22)
InChIKeyZQUULSZWGMQXAB-UHFFFAOYSA-N
XLogP3.17
TPSA73.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.38
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-fluoro-N-[3-(furan-2-ylmethoxy)propyl]pyridine-2-carboxamide
CID 115497634
methyl 6-[3-(furan-2-ylmethoxy)propylcarbamoyl]pyridine-3-carboxylate
CID 86921232
2,6-dichloro-N-[3-(furan-2-ylmethoxy)propyl]pyridine-4-carboxamide
CID 60706210
N-[3-(furan-2-ylmethoxy)propyl]-1-methyl-2,4-dioxopyrido[2,3-d]pyrimidine-7-carboxamide
CID 47055040
3-amino-N-[3-(furan-2-ylmethoxy)propyl]benzamide
CID 61275519
1-[3-(furan-2-ylmethoxy)propyl]-3-[3-(3-methoxyphenoxy)propyl]-2-methylguanidine
CID 111797710
7-fluoro-N-[3-(furan-2-ylmethoxy)propyl]-2-methylquinoline-4-carboxamide
CID 86930224
N-[3-(furan-2-ylmethoxy)propyl]-4-methylsulfanylbenzamide
CID 78832996
4-fluoro-N-[3-(furan-2-ylmethoxy)propyl]-3-methylbenzamide
CID 63213455
3-amino-N-[3-(furan-2-ylmethoxy)propyl]-1H-1,2,4-triazole-5-carboxamide
CID 55115340
N-[3-(furan-2-ylmethoxy)propyl]-N'-quinolin-6-yloxamide
CID 86996645
6-fluoro-N-(furan-2-ylmethyl)quinoline-2-carboxamide
CID 110464446

Frequently Asked Questions

What is the IUPAC name of N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide?
The IUPAC name of N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide (CID 78833071) is N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide.
What is the SMILES notation for N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide?
The canonical SMILES for N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide is COc1ccc2nc(C(=O)NCCCOCc3ccco3)ccc2c1.
What is the InChIKey of N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide?
The InChIKey is ZQUULSZWGMQXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O4/c1-23-15-6-8-17-14(12-15)5-7-18(21-17)19(22)20-9-3-10-24-13-16-4-2-11-25-16/h2,4-8,11-12H,3,9-10,13H2,1H3,(H,20,22).
What are the key properties of N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide?
N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide has a molecular weight of 340.38 g/mol, XLogP of 3.17, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(furan-2-ylmethoxy)propyl]-6-methoxyquinoline-2-carboxamide is sourced from PubChem (CID 78833071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).