3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile

C10H8N4O — CID 62671433

IUPAC3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCc1ccco1
InChIInChI=1S/C10H8N4O/c11-6-9-10(13-4-3-12-9)14-7-8-2-1-5-15-8/h1-5H,7H2,(H,13,14)
InChIKeyHXRYYPNZRTUTLU-UHFFFAOYSA-N
MW200.20 g/mol
LogP1.55
Rot. Bonds3

About 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile

3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile (PubChem CID 62671433) has the molecular formula C10H8N4O and a molecular weight of 200.20 g/mol. Its IUPAC name is 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
PubChem CID62671433
Molecular FormulaC10H8N4O
Molecular Weight200.20 g/mol
Exact Mass200.07
IUPAC Name3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCc1ccco1
InChIInChI=1S/C10H8N4O/c11-6-9-10(13-4-3-12-9)14-7-8-2-1-5-15-8/h1-5H,7H2,(H,13,14)
InChIKeyHXRYYPNZRTUTLU-UHFFFAOYSA-N
XLogP1.55
TPSA74.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.20
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(furan-2-ylmethylamino)pyridazine-4-carbonitrile
CID 80508635
4-(furan-2-ylmethylamino)pyridine-2-carbonitrile
CID 62924814
3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile
CID 55133484
3-fluoro-N-(furan-2-ylmethyl)pyridin-2-amine
CID 62733784
N-(furan-2-ylmethyl)pyrimidin-2-amine
CID 28514232
5-bromo-2-(furan-2-ylmethylamino)pyridine-3-carbonitrile
CID 82341774
3-[(5-bromothiophen-2-yl)methylamino]pyrazine-2-carbonitrile
CID 62672701
5-(furan-2-ylmethylamino)-2-methyl-1,3-oxazole-4-carbonitrile
CID 694867
3-(1,3-thiazol-5-ylmethylamino)pyrazine-2-carbonitrile
CID 104577496
3-[[3-(methoxymethyl)phenyl]methylamino]pyrazine-2-carbonitrile
CID 62672178
4-[(furan-2-ylmethylamino)methyl]pyridine-2-carbonitrile
CID 63881885
4-bromo-N-(furan-2-ylmethyl)-3-nitropyridin-2-amine
CID 24903357

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile?
The IUPAC name of 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile (CID 62671433) is 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile.
What is the SMILES notation for 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile?
The canonical SMILES for 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile is N#Cc1nccnc1NCc1ccco1.
What is the InChIKey of 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile?
The InChIKey is HXRYYPNZRTUTLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4O/c11-6-9-10(13-4-3-12-9)14-7-8-2-1-5-15-8/h1-5H,7H2,(H,13,14).
What are the key properties of 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile?
3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile has a molecular weight of 200.20 g/mol, XLogP of 1.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile is sourced from PubChem (CID 62671433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).