1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol

C10H11N3O — CID 20641667

IUPAC1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol
SMILESOC(CC1=CCC=N1)c1cnccn1
InChIInChI=1S/C10H11N3O/c14-10(6-8-2-1-3-12-8)9-7-11-4-5-13-9/h2-5,7,10,14H,1,6H2
InChIKeyNVZZYTBNKKZFKH-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.26
Rot. Bonds3

About 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol

1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol (PubChem CID 20641667) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol.

Molecular Properties

Compound Name1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol
PubChem CID20641667
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol
SMILESOC(CC1=CCC=N1)c1cnccn1
InChIInChI=1S/C10H11N3O/c14-10(6-8-2-1-3-12-8)9-7-11-4-5-13-9/h2-5,7,10,14H,1,6H2
InChIKeyNVZZYTBNKKZFKH-UHFFFAOYSA-N
XLogP1.26
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1R)-2-chloro-1-pyrazin-2-ylethanol
CID 55298108
2-(cyclohexen-1-yl)-1-pyrazin-2-ylethanol
CID 116660155
2-(1-benzothiophen-3-yl)-1-pyrazin-2-ylethanol
CID 63738461
(1S)-3-amino-1-pyrazin-2-ylpropan-1-ol
CID 96734232
(1S)-2-(methylamino)-1-pyrazin-2-ylethanol
CID 96734230
2-(1-methylimidazol-2-yl)-1-pyrazin-2-ylethanol
CID 79752608
2-(2-chloro-4-methylphenyl)-1-pyrazin-2-ylethanol
CID 106867263
2-(3-bromophenyl)-1-pyrazin-2-ylethanol
CID 60798703
4-pyrazin-2-ylbutane-1,1,1,4-tetrol
CID 87881315
3-methoxy-1-pyrazin-2-ylpropan-1-ol
CID 62608017
(1S)-2-azido-1-pyrazin-2-ylethanol
CID 83092675
2-(dimethylamino)-2-ethyl-1-pyrazin-2-ylbutan-1-ol
CID 79062480

Frequently Asked Questions

What is the IUPAC name of 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol?
The IUPAC name of 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol (CID 20641667) is 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol.
What is the SMILES notation for 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol?
The canonical SMILES for 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol is OC(CC1=CCC=N1)c1cnccn1.
What is the InChIKey of 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol?
The InChIKey is NVZZYTBNKKZFKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-10(6-8-2-1-3-12-8)9-7-11-4-5-13-9/h2-5,7,10,14H,1,6H2.
What are the key properties of 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol?
1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol has a molecular weight of 189.22 g/mol, XLogP of 1.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazin-2-yl-2-(3H-pyrrol-5-yl)ethanol is sourced from PubChem (CID 20641667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).