5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile

C11H15N3O — CID 79838651

IUPAC5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
SMILESCCN(CCOC)c1ccc(C#N)nc1
InChIInChI=1S/C11H15N3O/c1-3-14(6-7-15-2)11-5-4-10(8-12)13-9-11/h4-5,9H,3,6-7H2,1-2H3
InChIKeySXDHUHDPBFZLNK-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.43
Rot. Bonds5

About 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile

5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile (PubChem CID 79838651) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
PubChem CID79838651
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
SMILESCCN(CCOC)c1ccc(C#N)nc1
InChIInChI=1S/C11H15N3O/c1-3-14(6-7-15-2)11-5-4-10(8-12)13-9-11/h4-5,9H,3,6-7H2,1-2H3
InChIKeySXDHUHDPBFZLNK-UHFFFAOYSA-N
XLogP1.43
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The IUPAC name of 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile (CID 79838651) is 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile is CCN(CCOC)c1ccc(C#N)nc1.
What is the InChIKey of 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The InChIKey is SXDHUHDPBFZLNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-3-14(6-7-15-2)11-5-4-10(8-12)13-9-11/h4-5,9H,3,6-7H2,1-2H3.
What are the key properties of 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile has a molecular weight of 205.26 g/mol, XLogP of 1.43, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 79838651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).