N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

C20H19N3O3S — CID 91949459

IUPACN-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESO=C(NCCc1ccco1)C1CN(C(=O)c2cccs2)Cc2cccnc21
InChIInChI=1S/C20H19N3O3S/c24-19(22-9-7-15-5-2-10-26-15)16-13-23(20(25)17-6-3-11-27-17)12-14-4-1-8-21-18(14)16/h1-6,8,10-11,16H,7,9,12-13H2,(H,22,24)
InChIKeyNWDZOTMNKOAETH-UHFFFAOYSA-N
MW381.46 g/mol
LogP2.83
Rot. Bonds5

About N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide

N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (PubChem CID 91949459) has the molecular formula C20H19N3O3S and a molecular weight of 381.46 g/mol. Its IUPAC name is N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
PubChem CID91949459
Molecular FormulaC20H19N3O3S
Molecular Weight381.46 g/mol
Exact Mass381.11
IUPAC NameN-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide
SMILESO=C(NCCc1ccco1)C1CN(C(=O)c2cccs2)Cc2cccnc21
InChIInChI=1S/C20H19N3O3S/c24-19(22-9-7-15-5-2-10-26-15)16-13-23(20(25)17-6-3-11-27-17)12-14-4-1-8-21-18(14)16/h1-6,8,10-11,16H,7,9,12-13H2,(H,22,24)
InChIKeyNWDZOTMNKOAETH-UHFFFAOYSA-N
XLogP2.83
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.46
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-hydroxy-5-(5-((2-phenoxyethylamino)methyl)pyridin-2-yl)thiophene-2-carboxamide
CID 11696355
Thiophene-2-carboxylic acid {[(cyclopentylcarbamoyl-pyridin-3-yl-methyl)-furan-2-ylmethyl-carbamoyl]-methyl}-amide
CID 650746
Furan-2-carboxylic acid {[(cyclohexylcarbamoyl-pyridin-3-yl-methyl)-thiophen-2-ylmethyl-carbamoyl]-methyl}-amide
CID 3211853
N-(furan-2-ylmethyl)-2-phenyl-2-[pyridin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide
CID 3216731
N-(2-ethoxybenzyl)-1-{[3-(1H-pyrrol-1-yl)thien-2-yl]carbonyl}piperidine-4-carboxamide
CID 3241449
7-(6-ethoxy-3-pyridinyl)-2-pyridin-4-yl-5H-thieno[3,2-c]pyridin-4-one
CID 56683912
2-(3-fluoro-N-(2-thiophen-2-ylacetyl)anilino)-N-(furan-2-ylmethyl)-2-pyridin-4-ylacetamide
CID 3216722
N-(furan-2-ylmethyl)-2-(3-methyl-N-(2-thiophen-2-ylacetyl)anilino)-2-pyridin-4-ylacetamide
CID 3216724
2-(4-fluorophenyl)-N-(furan-2-ylmethyl)-2-[pyridin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide
CID 3216728
N-(furan-2-ylmethyl)-2-(4-methylphenyl)-2-[pyridin-3-yl-(2-thiophen-2-ylacetyl)amino]acetamide
CID 3216729
N-[(4-Ethoxyphenyl)methyl]-1-[3-(1H-pyrrol-1-YL)thiophene-2-carbonyl]piperidine-4-carboxamide
CID 16011396
Thiophene-2-carboxylic acid {[(cyclohexylcarbamoyl-pyridin-3-yl-methyl)-furan-2-ylmethyl-carbamoyl]-methyl}-amide
CID 3211279

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide (CID 91949459) is N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is O=C(NCCc1ccco1)C1CN(C(=O)c2cccs2)Cc2cccnc21.
What is the InChIKey of N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
The InChIKey is NWDZOTMNKOAETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3S/c24-19(22-9-7-15-5-2-10-26-15)16-13-23(20(25)17-6-3-11-27-17)12-14-4-1-8-21-18(14)16/h1-6,8,10-11,16H,7,9,12-13H2,(H,22,24).
What are the key properties of N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide?
N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide has a molecular weight of 381.46 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)ethyl]-6-(thiophene-2-carbonyl)-7,8-dihydro-5H-1,6-naphthyridine-8-carboxamide is sourced from PubChem (CID 91949459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).