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

C10H8N4S — CID 55133484

IUPAC3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCc1cccs1
InChIInChI=1S/C10H8N4S/c11-6-9-10(13-4-3-12-9)14-7-8-2-1-5-15-8/h1-5H,7H2,(H,13,14)
InChIKeyYCZRXVVDCGGIGC-UHFFFAOYSA-N
MW216.27 g/mol
LogP2.02
Rot. Bonds3

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

3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile (PubChem CID 55133484) has the molecular formula C10H8N4S and a molecular weight of 216.27 g/mol. Its IUPAC name is 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile
PubChem CID55133484
Molecular FormulaC10H8N4S
Molecular Weight216.27 g/mol
Exact Mass216.05
IUPAC Name3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCc1cccs1
InChIInChI=1S/C10H8N4S/c11-6-9-10(13-4-3-12-9)14-7-8-2-1-5-15-8/h1-5H,7H2,(H,13,14)
InChIKeyYCZRXVVDCGGIGC-UHFFFAOYSA-N
XLogP2.02
TPSA61.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-(1,3-thiazol-5-ylmethylamino)pyrazine-2-carbonitrile
CID 104577496
3-[(5-bromothiophen-2-yl)methylamino]pyrazine-2-carbonitrile
CID 62672701
3-(furan-2-ylmethylamino)pyrazine-2-carbonitrile
CID 62671433
3-[(4-hydroxyphenyl)methylamino]pyrazine-2-carbonitrile
CID 115605243
3-[(2-methyl-1,3-thiazol-4-yl)methylamino]pyrazine-2-carbonitrile
CID 62672892
1-methyl-3-(thiophen-2-ylmethylamino)pyrazin-2-one
CID 62939218
3-[(2-propoxy-3-pyridinyl)methylamino]pyrazine-2-carbonitrile
CID 133284272
3-[[3-(methoxymethyl)phenyl]methylamino]pyrazine-2-carbonitrile
CID 62672178
3-[(2-phenoxyphenyl)methylamino]pyrazine-2-carbonitrile
CID 133284487
3,5-dichloro-N-(thiophen-2-ylmethyl)pyridin-2-amine
CID 43242469
3-amino-2-(2-thiophen-2-ylethylamino)pyridine-4-carbonitrile
CID 82816718
5-chloro-N-(thiophen-2-ylmethyl)pyrimidin-2-amine
CID 79557672

Frequently Asked Questions

What is the IUPAC name of 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile?
The IUPAC name of 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile (CID 55133484) is 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile.
What is the SMILES notation for 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile?
The canonical SMILES for 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile is N#Cc1nccnc1NCc1cccs1.
What is the InChIKey of 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile?
The InChIKey is YCZRXVVDCGGIGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N4S/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-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile?
3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile has a molecular weight of 216.27 g/mol, XLogP of 2.02, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(thiophen-2-ylmethylamino)pyrazine-2-carbonitrile is sourced from PubChem (CID 55133484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).