N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide

C20H19N3O5 — CID 32993595

IUPACN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide
SMILESCOCCN(Cc1ccco1)C(=O)Cn1cnc2c(oc3ccccc32)c1=O
InChIInChI=1S/C20H19N3O5/c1-26-10-8-22(11-14-5-4-9-27-14)17(24)12-23-13-21-18-15-6-2-3-7-16(15)28-19(18)20(23)25/h2-7,9,13H,8,10-12H2,1H3
InChIKeyBFXYLZWEHZPDGJ-UHFFFAOYSA-N
MW381.39 g/mol
LogP2.41
Rot. Bonds7

About N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide

N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide (PubChem CID 32993595) has the molecular formula C20H19N3O5 and a molecular weight of 381.39 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide
PubChem CID32993595
Molecular FormulaC20H19N3O5
Molecular Weight381.39 g/mol
Exact Mass381.13
IUPAC NameN-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide
SMILESCOCCN(Cc1ccco1)C(=O)Cn1cnc2c(oc3ccccc32)c1=O
InChIInChI=1S/C20H19N3O5/c1-26-10-8-22(11-14-5-4-9-27-14)17(24)12-23-13-21-18-15-6-2-3-7-16(15)28-19(18)20(23)25/h2-7,9,13H,8,10-12H2,1H3
InChIKeyBFXYLZWEHZPDGJ-UHFFFAOYSA-N
XLogP2.41
TPSA90.71 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.39
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 3-[benzyl-[2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetyl]amino]propanoate
CID 55513165
N-benzyl-N-(furan-2-ylmethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)acetamide
CID 37428295
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(3-oxo-[1,2,4]triazolo[4,3-a]pyridin-2-yl)acetamide
CID 134059726
N-[2-[[2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetyl]amino]ethyl]furan-2-carboxamide
CID 33377017
3-[(2R)-3-(furan-2-ylmethoxy)-2-hydroxypropyl]-[1]benzofuro[3,2-d]pyrimidin-4-one
CID 31077133
N-(furan-2-ylmethyl)-2-(8-methyl-4-oxoquinazolin-3-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 134032634
N-[(2,4-difluorophenyl)methyl]-N-methyl-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide
CID 38227244
N-methyl-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)-N-piperidin-4-ylacetamide;hydrochloride
CID 119443323
[2-[benzyl(tert-butyl)amino]-2-oxoethyl] 2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetate
CID 46821949
(4-propoxyphenyl) 2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetate
CID 55382859
N-benzyl-N-(2-methoxyethyl)-2-(1-methyl-4-oxopyrazolo[5,4-d]pyrimidin-5-yl)acetamide
CID 38701595
N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide
CID 7735859

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide (CID 32993595) is N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide is COCCN(Cc1ccco1)C(=O)Cn1cnc2c(oc3ccccc32)c1=O.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide?
The InChIKey is BFXYLZWEHZPDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O5/c1-26-10-8-22(11-14-5-4-9-27-14)17(24)12-23-13-21-18-15-6-2-3-7-16(15)28-19(18)20(23)25/h2-7,9,13H,8,10-12H2,1H3.
What are the key properties of N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide?
N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide has a molecular weight of 381.39 g/mol, XLogP of 2.41, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(2-methoxyethyl)-2-(4-oxo-[1]benzofuro[3,2-d]pyrimidin-3-yl)acetamide is sourced from PubChem (CID 32993595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).