2-(pyrazin-2-ylamino)butan-1-ol

C8H13N3O — CID 43388780

IUPAC2-(pyrazin-2-ylamino)butan-1-ol
SMILESCCC(CO)Nc1cnccn1
InChIInChI=1S/C8H13N3O/c1-2-7(6-12)11-8-5-9-3-4-10-8/h3-5,7,12H,2,6H2,1H3,(H,10,11)
InChIKeyYOWZIKXWIHDFEZ-UHFFFAOYSA-N
MW167.21 g/mol
LogP0.66
Rot. Bonds4

About 2-(pyrazin-2-ylamino)butan-1-ol

2-(pyrazin-2-ylamino)butan-1-ol (PubChem CID 43388780) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is 2-(pyrazin-2-ylamino)butan-1-ol.

Molecular Properties

Compound Name2-(pyrazin-2-ylamino)butan-1-ol
PubChem CID43388780
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name2-(pyrazin-2-ylamino)butan-1-ol
SMILESCCC(CO)Nc1cnccn1
InChIInChI=1S/C8H13N3O/c1-2-7(6-12)11-8-5-9-3-4-10-8/h3-5,7,12H,2,6H2,1H3,(H,10,11)
InChIKeyYOWZIKXWIHDFEZ-UHFFFAOYSA-N
XLogP0.66
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-[(4-methyl-2-pyridinyl)amino]butan-1-ol
CID 130720526
(2R)-2-(1-pyrazin-2-ylethylamino)butan-1-ol
CID 103922625
N-pentan-2-ylpyrazin-2-amine
CID 43107057
(2S)-2-[(3-aminopyrazin-2-yl)amino]butan-1-ol
CID 131154572
2-[(5-bromo-2-pyridinyl)amino]butan-1-ol
CID 43500164
4-methyl-2-N-pyrazin-2-ylpentane-1,2-diamine
CID 63759425
(2S)-2-[(2-methylpyrimidin-4-yl)amino]butan-1-ol
CID 94586923
2-phenyl-2-(pyrazin-2-ylamino)ethanol
CID 63183280
2-[[5-(ethylamino)-2-pyridinyl]amino]butan-1-ol
CID 82104378
2-[(2-chloropyrimidin-4-yl)amino]butan-1-ol
CID 60726838
2-(quinoxalin-2-ylamino)butan-1-ol
CID 47142817
(2R)-2-[(2-propan-2-ylpyrimidin-4-yl)amino]butan-1-ol
CID 133434731

Frequently Asked Questions

What is the IUPAC name of 2-(pyrazin-2-ylamino)butan-1-ol?
The IUPAC name of 2-(pyrazin-2-ylamino)butan-1-ol (CID 43388780) is 2-(pyrazin-2-ylamino)butan-1-ol.
What is the SMILES notation for 2-(pyrazin-2-ylamino)butan-1-ol?
The canonical SMILES for 2-(pyrazin-2-ylamino)butan-1-ol is CCC(CO)Nc1cnccn1.
What is the InChIKey of 2-(pyrazin-2-ylamino)butan-1-ol?
The InChIKey is YOWZIKXWIHDFEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3O/c1-2-7(6-12)11-8-5-9-3-4-10-8/h3-5,7,12H,2,6H2,1H3,(H,10,11).
What are the key properties of 2-(pyrazin-2-ylamino)butan-1-ol?
2-(pyrazin-2-ylamino)butan-1-ol has a molecular weight of 167.21 g/mol, XLogP of 0.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pyrazin-2-ylamino)butan-1-ol is sourced from PubChem (CID 43388780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).