N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide

C17H16N4O3 — CID 162671731

IUPACN-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide
SMILESCOc1ccc2c(c1)-n1ncc(C(=O)NCc3ccco3)c1NC2
InChIInChI=1S/C17H16N4O3/c1-23-12-5-4-11-8-18-16-14(10-20-21(16)15(11)7-12)17(22)19-9-13-3-2-6-24-13/h2-7,10,18H,8-9H2,1H3,(H,19,22)
InChIKeyHTBBRVZAIIOICV-UHFFFAOYSA-N
MW324.34 g/mol
LogP2.33
Rot. Bonds4

About N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide

N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide (PubChem CID 162671731) has the molecular formula C17H16N4O3 and a molecular weight of 324.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide
PubChem CID162671731
Molecular FormulaC17H16N4O3
Molecular Weight324.34 g/mol
Exact Mass324.12
IUPAC NameN-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide
SMILESCOc1ccc2c(c1)-n1ncc(C(=O)NCc3ccco3)c1NC2
InChIInChI=1S/C17H16N4O3/c1-23-12-5-4-11-8-18-16-14(10-20-21(16)15(11)7-12)17(22)19-9-13-3-2-6-24-13/h2-7,10,18H,8-9H2,1H3,(H,19,22)
InChIKeyHTBBRVZAIIOICV-UHFFFAOYSA-N
XLogP2.33
TPSA81.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.34
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(furan-2-ylmethyl)-2,4-dimethoxybenzamide
CID 3118683
(5S,7S)-N-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1141019
(5S,7R)-N-(furan-2-ylmethyl)-5-(3-methoxyphenyl)-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 1141022
N-(furan-2-ylmethyl)-6-methoxy-1H-indazole-3-carboxamide
CID 110469584
N-(furan-2-ylmethyl)-2,4,5-trimethoxybenzamide
CID 1089288
N-(furan-2-ylmethyl)-2-[[2-(3-methoxyphenoxy)acetyl]amino]benzamide
CID 94878119
5-(2,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 3235828
4-(2,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)piperazine-1-carboxamide
CID 113106508
3-(2,4-dimethoxyphenyl)-N-(furan-2-ylmethyl)-4-oxophthalazine-1-carboxamide
CID 3450101
N-(furan-2-ylmethyl)-6-methoxy-3-methyl-1H-indole-2-carboxamide
CID 113205399
N-(furan-2-ylmethyl)-6-methoxy-2-methyl-1H-indole-3-carboxamide
CID 110850471
N-(furan-2-ylmethyl)-4-[(3-methoxyphenyl)methylideneamino]-1-methylpyrazole-5-carboxamide
CID 4862901

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide (CID 162671731) is N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide is COc1ccc2c(c1)-n1ncc(C(=O)NCc3ccco3)c1NC2.
What is the InChIKey of N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide?
The InChIKey is HTBBRVZAIIOICV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3/c1-23-12-5-4-11-8-18-16-14(10-20-21(16)15(11)7-12)17(22)19-9-13-3-2-6-24-13/h2-7,10,18H,8-9H2,1H3,(H,19,22).
What are the key properties of N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide?
N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide has a molecular weight of 324.34 g/mol, XLogP of 2.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-8-methoxy-4,5-dihydropyrazolo[1,5-a]quinazoline-3-carboxamide is sourced from PubChem (CID 162671731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).