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

C15H17N3O3 — CID 121198919

IUPACN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide
SMILESO=C(NCc1nccnc1-c1ccco1)C1CCOCC1
InChIInChI=1S/C15H17N3O3/c19-15(11-3-8-20-9-4-11)18-10-12-14(17-6-5-16-12)13-2-1-7-21-13/h1-2,5-7,11H,3-4,8-10H2,(H,18,19)
InChIKeyHKLLARCSSUKYMF-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.78
Rot. Bonds4

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

N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide (PubChem CID 121198919) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide.

Molecular Properties

Compound NameN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide
PubChem CID121198919
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC NameN-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide
SMILESO=C(NCc1nccnc1-c1ccco1)C1CCOCC1
InChIInChI=1S/C15H17N3O3/c19-15(11-3-8-20-9-4-11)18-10-12-14(17-6-5-16-12)13-2-1-7-21-13/h1-2,5-7,11H,3-4,8-10H2,(H,18,19)
InChIKeyHKLLARCSSUKYMF-UHFFFAOYSA-N
XLogP1.78
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-5-methylpyrazine-2-carboxamide
CID 119105889
1-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3-propan-2-ylurea
CID 121199008
1-(2,6-difluorophenyl)-3-[[3-(furan-2-yl)pyrazin-2-yl]methyl]urea
CID 121199004
2-(1-adamantyl)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]acetamide
CID 121198813
1-(1,1-dioxothiolan-3-yl)-3-[[3-(furan-2-yl)pyrazin-2-yl]methyl]urea
CID 121198954
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-2-pyrrol-1-ylacetamide
CID 121198831
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]pentanamide
CID 121198710
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]naphthalene-1-carboxamide
CID 121198866
(E)-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3-phenylprop-2-enamide
CID 121198721
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-5-methylthiophene-2-carboxamide
CID 121198890
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]-3-methylbenzamide
CID 121023120
3-chloro-N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]benzamide
CID 121198851

Frequently Asked Questions

What is the IUPAC name of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide?
The IUPAC name of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide (CID 121198919) is N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide.
What is the SMILES notation for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide?
The canonical SMILES for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide is O=C(NCc1nccnc1-c1ccco1)C1CCOCC1.
What is the InChIKey of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide?
The InChIKey is HKLLARCSSUKYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c19-15(11-3-8-20-9-4-11)18-10-12-14(17-6-5-16-12)13-2-1-7-21-13/h1-2,5-7,11H,3-4,8-10H2,(H,18,19).
What are the key properties of N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide?
N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.78, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(furan-2-yl)pyrazin-2-yl]methyl]oxane-4-carboxamide is sourced from PubChem (CID 121198919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).