6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile

C14H19N3O — CID 64594719

IUPAC6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
SMILESCOCCN(c1cccc(C#N)n1)C(C)C1CC1
InChIInChI=1S/C14H19N3O/c1-11(12-6-7-12)17(8-9-18-2)14-5-3-4-13(10-15)16-14/h3-5,11-12H,6-9H2,1-2H3
InChIKeyYZLCEKMBYAOGCE-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.20
Rot. Bonds6

About 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile

6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile (PubChem CID 64594719) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
PubChem CID64594719
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile
SMILESCOCCN(c1cccc(C#N)n1)C(C)C1CC1
InChIInChI=1S/C14H19N3O/c1-11(12-6-7-12)17(8-9-18-2)14-5-3-4-13(10-15)16-14/h3-5,11-12H,6-9H2,1-2H3
InChIKeyYZLCEKMBYAOGCE-UHFFFAOYSA-N
XLogP2.20
TPSA49.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The IUPAC name of 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile (CID 64594719) is 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile is COCCN(c1cccc(C#N)n1)C(C)C1CC1.
What is the InChIKey of 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
The InChIKey is YZLCEKMBYAOGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-11(12-6-7-12)17(8-9-18-2)14-5-3-4-13(10-15)16-14/h3-5,11-12H,6-9H2,1-2H3.
What are the key properties of 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile?
6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile has a molecular weight of 245.33 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-cyclopropylethyl(2-methoxyethyl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 64594719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).