6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile

C11H13N3O — CID 64587411

IUPAC6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N(CCO)C2CC2)n1
InChIInChI=1S/C11H13N3O/c12-8-9-2-1-3-11(13-9)14(6-7-15)10-4-5-10/h1-3,10,15H,4-7H2
InChIKeyVGXDUKJNZRRYFS-UHFFFAOYSA-N
MW203.25 g/mol
LogP0.91
Rot. Bonds4

About 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile

6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile (PubChem CID 64587411) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile
PubChem CID64587411
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile
SMILESN#Cc1cccc(N(CCO)C2CC2)n1
InChIInChI=1S/C11H13N3O/c12-8-9-2-1-3-11(13-9)14(6-7-15)10-4-5-10/h1-3,10,15H,4-7H2
InChIKeyVGXDUKJNZRRYFS-UHFFFAOYSA-N
XLogP0.91
TPSA60.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 50.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile?
The IUPAC name of 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile (CID 64587411) is 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile is N#Cc1cccc(N(CCO)C2CC2)n1.
What is the InChIKey of 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile?
The InChIKey is VGXDUKJNZRRYFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c12-8-9-2-1-3-11(13-9)14(6-7-15)10-4-5-10/h1-3,10,15H,4-7H2.
What are the key properties of 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile?
6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile has a molecular weight of 203.25 g/mol, XLogP of 0.91, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[cyclopropyl(2-hydroxyethyl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 64587411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).