2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile

C10H14N4 — CID 130631933

IUPAC2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile
SMILESCCc1nc(C#N)cc(N(C)CC)n1
InChIInChI=1S/C10H14N4/c1-4-9-12-8(7-11)6-10(13-9)14(3)5-2/h6H,4-5H2,1-3H3
InChIKeyXTIULIQRBWDOHU-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.37
Rot. Bonds3

About 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile

2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile (PubChem CID 130631933) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile.

Molecular Properties

Compound Name2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile
PubChem CID130631933
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile
SMILESCCc1nc(C#N)cc(N(C)CC)n1
InChIInChI=1S/C10H14N4/c1-4-9-12-8(7-11)6-10(13-9)14(3)5-2/h6H,4-5H2,1-3H3
InChIKeyXTIULIQRBWDOHU-UHFFFAOYSA-N
XLogP1.37
TPSA52.81 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile?
The IUPAC name of 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile (CID 130631933) is 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile.
What is the SMILES notation for 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile?
The canonical SMILES for 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile is CCc1nc(C#N)cc(N(C)CC)n1.
What is the InChIKey of 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile?
The InChIKey is XTIULIQRBWDOHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-4-9-12-8(7-11)6-10(13-9)14(3)5-2/h6H,4-5H2,1-3H3.
What are the key properties of 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile?
2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile has a molecular weight of 190.25 g/mol, XLogP of 1.37, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-[ethyl(methyl)amino]pyrimidine-4-carbonitrile is sourced from PubChem (CID 130631933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).