N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide

C19H19N3O2 — CID 122162929

IUPACN-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide
SMILESCCCc1ccc(C(=O)NCc2nccnc2-c2ccoc2)cc1
InChIInChI=1S/C19H19N3O2/c1-2-3-14-4-6-15(7-5-14)19(23)22-12-17-18(21-10-9-20-17)16-8-11-24-13-16/h4-11,13H,2-3,12H2,1H3,(H,22,23)
InChIKeyFUFNSWDAWLUNSM-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.62
Rot. Bonds6

About N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide

N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide (PubChem CID 122162929) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide.

Molecular Properties

Compound NameN-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide
PubChem CID122162929
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide
SMILESCCCc1ccc(C(=O)NCc2nccnc2-c2ccoc2)cc1
InChIInChI=1S/C19H19N3O2/c1-2-3-14-4-6-15(7-5-14)19(23)22-12-17-18(21-10-9-20-17)16-8-11-24-13-16/h4-11,13H,2-3,12H2,1H3,(H,22,23)
InChIKeyFUFNSWDAWLUNSM-UHFFFAOYSA-N
XLogP3.62
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-4-propylbenzamide
CID 121022431
2-(4-ethoxyphenyl)-N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]acetamide
CID 122162936
5-fluoro-N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]pyridine-3-carboxamide
CID 122163013
3-(4-fluoro-3-methylphenyl)-N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]propanamide
CID 122246957
N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-2-naphthalen-1-ylacetamide
CID 122162973
N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-3-pyridin-2-yloxybenzamide
CID 122162985
N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-3-(3-methylthiophen-2-yl)propanamide
CID 122246956
N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-3-(2-methoxyphenyl)-1H-pyrazole-5-carboxamide
CID 122162980
N-[(3-pyridin-4-ylpyrazin-2-yl)methyl]benzamide
CID 126854250
methyl 4-[[4-(furan-3-yl)phenyl]methylcarbamoyl]benzoate
CID 119103319
N-[[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]methyl]benzamide
CID 122162703
N-[[6-(furan-3-yl)-3-pyridinyl]methyl]-4-methoxybenzamide
CID 121196612

Frequently Asked Questions

What is the IUPAC name of N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide?
The IUPAC name of N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide (CID 122162929) is N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide.
What is the SMILES notation for N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide?
The canonical SMILES for N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide is CCCc1ccc(C(=O)NCc2nccnc2-c2ccoc2)cc1.
What is the InChIKey of N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide?
The InChIKey is FUFNSWDAWLUNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-2-3-14-4-6-15(7-5-14)19(23)22-12-17-18(21-10-9-20-17)16-8-11-24-13-16/h4-11,13H,2-3,12H2,1H3,(H,22,23).
What are the key properties of N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide?
N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide has a molecular weight of 321.38 g/mol, XLogP of 3.62, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(furan-3-yl)pyrazin-2-yl]methyl]-4-propylbenzamide is sourced from PubChem (CID 122162929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).