3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile

C11H14N4O — CID 62685373

IUPAC3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1OCC1CCNCC1
InChIInChI=1S/C11H14N4O/c12-7-10-11(15-6-5-14-10)16-8-9-1-3-13-4-2-9/h5-6,9,13H,1-4,8H2
InChIKeyKHIZWMLUCIPPAO-UHFFFAOYSA-N
MW218.26 g/mol
LogP0.73
Rot. Bonds3

About 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile

3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile (PubChem CID 62685373) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile
PubChem CID62685373
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1OCC1CCNCC1
InChIInChI=1S/C11H14N4O/c12-7-10-11(15-6-5-14-10)16-8-9-1-3-13-4-2-9/h5-6,9,13H,1-4,8H2
InChIKeyKHIZWMLUCIPPAO-UHFFFAOYSA-N
XLogP0.73
TPSA70.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-chloro-2-(piperidin-4-ylmethoxy)pyridine-4-carbonitrile
CID 107061650
1-(piperidin-4-ylmethoxy)isoquinoline-7-carbonitrile
CID 82569764
1-(piperidin-4-ylmethoxy)isoquinoline-5-carbonitrile
CID 82569770
1-(piperidin-4-ylmethoxy)isoquinoline-6-carbonitrile
CID 82569767
2-(piperidin-4-ylmethoxy)pyridin-3-ol
CID 71646429
4-(piperidin-4-ylmethoxy)benzonitrile
CID 10560682
3-[cyclopropyl(piperidin-4-ylmethyl)amino]pyrazine-2-carbonitrile
CID 79719645
3-chloro-2-(piperidin-4-ylmethoxy)pyridine;hydrochloride
CID 162422899
2-(piperidin-4-ylmethoxy)pyrazine;hydrochloride
CID 71636924
4-(piperidin-4-ylmethoxy)-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 55121513
3-[2-[cyclopropyl(methyl)amino]ethoxy]pyrazine-2-carbonitrile
CID 102740080
2,6-difluoro-4-(piperidin-4-ylmethoxy)benzonitrile
CID 126695840

Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile?
The IUPAC name of 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile (CID 62685373) is 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile.
What is the SMILES notation for 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile?
The canonical SMILES for 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile is N#Cc1nccnc1OCC1CCNCC1.
What is the InChIKey of 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile?
The InChIKey is KHIZWMLUCIPPAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c12-7-10-11(15-6-5-14-10)16-8-9-1-3-13-4-2-9/h5-6,9,13H,1-4,8H2.
What are the key properties of 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile?
3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile has a molecular weight of 218.26 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-4-ylmethoxy)pyrazine-2-carbonitrile is sourced from PubChem (CID 62685373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).