1-(1-pyrazin-2-ylethylamino)pentan-2-ol

C11H19N3O — CID 115719323

IUPAC1-(1-pyrazin-2-ylethylamino)pentan-2-ol
SMILESCCCC(O)CNC(C)c1cnccn1
InChIInChI=1S/C11H19N3O/c1-3-4-10(15)7-14-9(2)11-8-12-5-6-13-11/h5-6,8-10,14-15H,3-4,7H2,1-2H3
InChIKeyYOTHJFSKNZEWDM-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.29
Rot. Bonds6

About 1-(1-pyrazin-2-ylethylamino)pentan-2-ol

1-(1-pyrazin-2-ylethylamino)pentan-2-ol (PubChem CID 115719323) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(1-pyrazin-2-ylethylamino)pentan-2-ol.

Molecular Properties

Compound Name1-(1-pyrazin-2-ylethylamino)pentan-2-ol
PubChem CID115719323
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-(1-pyrazin-2-ylethylamino)pentan-2-ol
SMILESCCCC(O)CNC(C)c1cnccn1
InChIInChI=1S/C11H19N3O/c1-3-4-10(15)7-14-9(2)11-8-12-5-6-13-11/h5-6,8-10,14-15H,3-4,7H2,1-2H3
InChIKeyYOTHJFSKNZEWDM-UHFFFAOYSA-N
XLogP1.29
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-ethyl-1-(1-pyrazin-2-ylethylamino)pentan-2-ol
CID 103783040
1,1-difluoro-3-(1-pyrazin-2-ylethylamino)propan-2-ol
CID 103787955
1,1,1-trifluoro-3-(1-pyrazin-2-ylethylamino)propan-2-ol
CID 115712106
5-methyl-N-(1-pyrazin-2-ylethyl)hexan-1-amine
CID 81338055
3-methylsulfinyl-N-(1-pyrazin-2-ylethyl)butan-1-amine
CID 115894563
4,4-dimethyl-N-(1-pyrazin-2-ylethyl)pentan-1-amine
CID 115891455
1-[[(1S)-1-pyridin-2-ylethyl]amino]butan-2-ol
CID 81401299
(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
CID 103922625
1-[1-(2-methylpyrazol-3-yl)ethylamino]pentan-2-ol
CID 106758117
1-[(1-pyrazin-2-ylethylamino)methyl]cyclobutan-1-ol
CID 115718531
(1S)-2-(methylamino)-1-pyrazin-2-ylethanol
CID 96734230
ethyl 4-(1-pyrazin-2-ylethylamino)butanoate
CID 64580462

Frequently Asked Questions

What is the IUPAC name of 1-(1-pyrazin-2-ylethylamino)pentan-2-ol?
The IUPAC name of 1-(1-pyrazin-2-ylethylamino)pentan-2-ol (CID 115719323) is 1-(1-pyrazin-2-ylethylamino)pentan-2-ol.
What is the SMILES notation for 1-(1-pyrazin-2-ylethylamino)pentan-2-ol?
The canonical SMILES for 1-(1-pyrazin-2-ylethylamino)pentan-2-ol is CCCC(O)CNC(C)c1cnccn1.
What is the InChIKey of 1-(1-pyrazin-2-ylethylamino)pentan-2-ol?
The InChIKey is YOTHJFSKNZEWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-3-4-10(15)7-14-9(2)11-8-12-5-6-13-11/h5-6,8-10,14-15H,3-4,7H2,1-2H3.
What are the key properties of 1-(1-pyrazin-2-ylethylamino)pentan-2-ol?
1-(1-pyrazin-2-ylethylamino)pentan-2-ol has a molecular weight of 209.29 g/mol, XLogP of 1.29, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-pyrazin-2-ylethylamino)pentan-2-ol is sourced from PubChem (CID 115719323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).