3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide

C19H14N4O5 — CID 44783091

IUPAC3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2ncc(NC(=O)c3ccco3)c(=O)n2c1
InChIInChI=1S/C19H14N4O5/c24-17(21-9-13-3-1-7-27-13)12-5-6-16-20-10-14(19(26)23(16)11-12)22-18(25)15-4-2-8-28-15/h1-8,10-11H,9H2,(H,21,24)(H,22,25)
InChIKeyGUCMAGZKVUBELH-UHFFFAOYSA-N
MW378.34 g/mol
LogP2.06
Rot. Bonds5

About 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide

3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide (PubChem CID 44783091) has the molecular formula C19H14N4O5 and a molecular weight of 378.34 g/mol. Its IUPAC name is 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide.

Molecular Properties

Compound Name3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
PubChem CID44783091
Molecular FormulaC19H14N4O5
Molecular Weight378.34 g/mol
Exact Mass378.10
IUPAC Name3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
SMILESO=C(NCc1ccco1)c1ccc2ncc(NC(=O)c3ccco3)c(=O)n2c1
InChIInChI=1S/C19H14N4O5/c24-17(21-9-13-3-1-7-27-13)12-5-6-16-20-10-14(19(26)23(16)11-12)22-18(25)15-4-2-8-28-15/h1-8,10-11H,9H2,(H,21,24)(H,22,25)
InChIKeyGUCMAGZKVUBELH-UHFFFAOYSA-N
XLogP2.06
TPSA118.85 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.34
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide with MolForge

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Related Compounds

N-(furan-2-ylmethyl)-3-(3-methylbutanoylamino)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
CID 44783089
ethyl 2-[[3-(furan-2-carbonylamino)-4-oxopyrido[1,2-a]pyrimidine-7-carbonyl]amino]acetate
CID 44782906
3-[(2-cyanophenyl)methylamino]-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide
CID 44783155
N-[4-(furan-2-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 976453
N-[2-(dimethylamino)ethyl]-4-oxo-3-(3-phenylpropanoylamino)pyrido[1,2-a]pyrimidine-7-carboxamide
CID 44782920
N-(furan-2-ylmethyl)-1-phenylpyrazole-4-carboxamide
CID 9034607
N-[2-methyl-5-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethylcarbamoyl)phenyl]furan-2-carboxamide
CID 17461631
N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-6-methoxypyridine-3-carboxamide
CID 34657042
4-(chloromethyl)-N-(furan-2-ylmethyl)benzamide
CID 43156226
N-(furan-2-ylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 109254918
1-N-(furan-2-ylmethyl)-4-N-quinolin-8-ylbenzene-1,4-dicarboxamide
CID 109046640
4-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 27649984

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide?
The IUPAC name of 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide (CID 44783091) is 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide.
What is the SMILES notation for 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide?
The canonical SMILES for 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide is O=C(NCc1ccco1)c1ccc2ncc(NC(=O)c3ccco3)c(=O)n2c1.
What is the InChIKey of 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide?
The InChIKey is GUCMAGZKVUBELH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O5/c24-17(21-9-13-3-1-7-27-13)12-5-6-16-20-10-14(19(26)23(16)11-12)22-18(25)15-4-2-8-28-15/h1-8,10-11H,9H2,(H,21,24)(H,22,25).
What are the key properties of 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide?
3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide has a molecular weight of 378.34 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-carbonylamino)-N-(furan-2-ylmethyl)-4-oxopyrido[1,2-a]pyrimidine-7-carboxamide is sourced from PubChem (CID 44783091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).