3-[ethyl(propyl)amino]pyrazine-2-carbonitrile

C10H14N4 — CID 62685381

IUPAC3-[ethyl(propyl)amino]pyrazine-2-carbonitrile
SMILESCCCN(CC)c1nccnc1C#N
InChIInChI=1S/C10H14N4/c1-3-7-14(4-2)10-9(8-11)12-5-6-13-10/h5-6H,3-4,7H2,1-2H3
InChIKeyKQMZOXXZFWFTPI-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.58
Rot. Bonds4

About 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile

3-[ethyl(propyl)amino]pyrazine-2-carbonitrile (PubChem CID 62685381) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-[ethyl(propyl)amino]pyrazine-2-carbonitrile
PubChem CID62685381
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name3-[ethyl(propyl)amino]pyrazine-2-carbonitrile
SMILESCCCN(CC)c1nccnc1C#N
InChIInChI=1S/C10H14N4/c1-3-7-14(4-2)10-9(8-11)12-5-6-13-10/h5-6H,3-4,7H2,1-2H3
InChIKeyKQMZOXXZFWFTPI-UHFFFAOYSA-N
XLogP1.58
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-[methyl(propyl)amino]pyrazine-2-carbonitrile
CID 62685552
3-[ethyl(2-methylbutyl)amino]pyrazine-2-carbonitrile
CID 79470228
3-[ethyl-[(1-methylpyrazol-4-yl)methyl]amino]pyrazine-2-carbonitrile
CID 133284444
3-[butan-2-yl(methyl)amino]pyrazine-2-carbonitrile
CID 62685730
3-[ethyl(piperidin-3-ylmethyl)amino]pyrazine-2-carbonitrile
CID 106643570
3-[piperidin-3-yl(propyl)amino]pyrazine-2-carbonitrile
CID 63636497
3-[2-methylpropyl(pentan-3-yl)amino]pyrazine-2-carbonitrile
CID 79491028
3-[5-hydroxypentyl(methyl)amino]pyrazine-2-carbonitrile
CID 107199606
methyl 3-[(3-cyanopyrazin-2-yl)-(2-methoxyethyl)amino]propanoate
CID 113330474
2-[2-aminoethyl(ethyl)amino]pyridine-3-carbonitrile
CID 114900544
2-(diethylamino)pyridine-3-carbonitrile
CID 10012430
1-(dipropylamino)isoquinoline-7-carbonitrile
CID 21085197

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile?
The IUPAC name of 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile (CID 62685381) is 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile.
What is the SMILES notation for 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile?
The canonical SMILES for 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile is CCCN(CC)c1nccnc1C#N.
What is the InChIKey of 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile?
The InChIKey is KQMZOXXZFWFTPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-3-7-14(4-2)10-9(8-11)12-5-6-13-10/h5-6H,3-4,7H2,1-2H3.
What are the key properties of 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile?
3-[ethyl(propyl)amino]pyrazine-2-carbonitrile has a molecular weight of 190.25 g/mol, XLogP of 1.58, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(propyl)amino]pyrazine-2-carbonitrile is sourced from PubChem (CID 62685381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).