[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol

C10H11ClN4O — CID 59570672

IUPAC[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol
SMILESCc1cc(C)n(-c2cnc(CO)c(Cl)n2)n1
InChIInChI=1S/C10H11ClN4O/c1-6-3-7(2)15(14-6)9-4-12-8(5-16)10(11)13-9/h3-4,16H,5H2,1-2H3
InChIKeyWULBTSIEAHBRRF-UHFFFAOYSA-N
MW238.68 g/mol
LogP1.42
Rot. Bonds2

About [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol

[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol (PubChem CID 59570672) has the molecular formula C10H11ClN4O and a molecular weight of 238.68 g/mol. Its IUPAC name is [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol.

Molecular Properties

Compound Name[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol
PubChem CID59570672
Molecular FormulaC10H11ClN4O
Molecular Weight238.68 g/mol
Exact Mass238.06
IUPAC Name[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol
SMILESCc1cc(C)n(-c2cnc(CO)c(Cl)n2)n1
InChIInChI=1S/C10H11ClN4O/c1-6-3-7(2)15(14-6)9-4-12-8(5-16)10(11)13-9/h3-4,16H,5H2,1-2H3
InChIKeyWULBTSIEAHBRRF-UHFFFAOYSA-N
XLogP1.42
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.68
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazine-2-carbaldehyde;5-chloro-3-(3,5-dimethylpyrazol-1-yl)pyrazine-2-carbaldehyde
CID 160885303
4-chloro-6-(3,5-dimethylpyrazol-1-yl)-2-methylpyrimidine
CID 762223
(2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]propan-1-ol
CID 133428096
2-chloro-6-(3,5-dimethylpyrazol-1-yl)-4-methylpyridine
CID 139300479
4,6-bis(3,5-dimethylpyrazol-1-yl)-2-methylpyrimidine
CID 102051125
6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 80647714
[2-(3,5-dimethylpyrazol-1-yl)phenyl]methanol
CID 12746736
(2S)-2-[[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]amino]propanoic acid
CID 122049461
2-chloro-N-(2,2-dimethylpropyl)-6-(3,5-dimethylpyrazol-1-yl)pyridin-4-amine
CID 139300724
[2-(3,5-dimethylpyrazol-1-yl)-4,6-dimethyl-3-pyridinyl]methanol
CID 61255211
1-[4-[6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]piperazin-1-yl]-2-methoxyethanone
CID 133283460
N-(4-chlorophenyl)-6-(3,5-dimethylpyrazol-1-yl)pyrazin-2-amine
CID 25230411

Frequently Asked Questions

What is the IUPAC name of [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol?
The IUPAC name of [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol (CID 59570672) is [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol.
What is the SMILES notation for [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol?
The canonical SMILES for [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol is Cc1cc(C)n(-c2cnc(CO)c(Cl)n2)n1.
What is the InChIKey of [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol?
The InChIKey is WULBTSIEAHBRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN4O/c1-6-3-7(2)15(14-6)9-4-12-8(5-16)10(11)13-9/h3-4,16H,5H2,1-2H3.
What are the key properties of [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol?
[3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol has a molecular weight of 238.68 g/mol, XLogP of 1.42, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-5-(3,5-dimethylpyrazol-1-yl)pyrazin-2-yl]methanol is sourced from PubChem (CID 59570672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).