[1-(pyrazin-2-ylamino)cyclohexyl]methanol

C11H17N3O — CID 62521523

IUPAC[1-(pyrazin-2-ylamino)cyclohexyl]methanol
SMILESOCC1(Nc2cnccn2)CCCCC1
InChIInChI=1S/C11H17N3O/c15-9-11(4-2-1-3-5-11)14-10-8-12-6-7-13-10/h6-8,15H,1-5,9H2,(H,13,14)
InChIKeyALFOCWKCOPJGGJ-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.58
Rot. Bonds3

About [1-(pyrazin-2-ylamino)cyclohexyl]methanol

[1-(pyrazin-2-ylamino)cyclohexyl]methanol (PubChem CID 62521523) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is [1-(pyrazin-2-ylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(pyrazin-2-ylamino)cyclohexyl]methanol
PubChem CID62521523
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name[1-(pyrazin-2-ylamino)cyclohexyl]methanol
SMILESOCC1(Nc2cnccn2)CCCCC1
InChIInChI=1S/C11H17N3O/c15-9-11(4-2-1-3-5-11)14-10-8-12-6-7-13-10/h6-8,15H,1-5,9H2,(H,13,14)
InChIKeyALFOCWKCOPJGGJ-UHFFFAOYSA-N
XLogP1.58
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-(pyrazin-2-ylamino)cyclohexyl]methanol?
The IUPAC name of [1-(pyrazin-2-ylamino)cyclohexyl]methanol (CID 62521523) is [1-(pyrazin-2-ylamino)cyclohexyl]methanol.
What is the SMILES notation for [1-(pyrazin-2-ylamino)cyclohexyl]methanol?
The canonical SMILES for [1-(pyrazin-2-ylamino)cyclohexyl]methanol is OCC1(Nc2cnccn2)CCCCC1.
What is the InChIKey of [1-(pyrazin-2-ylamino)cyclohexyl]methanol?
The InChIKey is ALFOCWKCOPJGGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c15-9-11(4-2-1-3-5-11)14-10-8-12-6-7-13-10/h6-8,15H,1-5,9H2,(H,13,14).
What are the key properties of [1-(pyrazin-2-ylamino)cyclohexyl]methanol?
[1-(pyrazin-2-ylamino)cyclohexyl]methanol has a molecular weight of 207.28 g/mol, XLogP of 1.58, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(pyrazin-2-ylamino)cyclohexyl]methanol is sourced from PubChem (CID 62521523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).