(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol

C10H11ClN2O2 — CID 106693588

IUPAC(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol
SMILESCCn1cc(C(O)c2ccc(Cl)o2)cn1
InChIInChI=1S/C10H11ClN2O2/c1-2-13-6-7(5-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3
InChIKeyZZLKHWAMVNBSEU-UHFFFAOYSA-N
MW226.66 g/mol
LogP2.23
Rot. Bonds3

About (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol

(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol (PubChem CID 106693588) has the molecular formula C10H11ClN2O2 and a molecular weight of 226.66 g/mol. Its IUPAC name is (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol.

Molecular Properties

Compound Name(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol
PubChem CID106693588
Molecular FormulaC10H11ClN2O2
Molecular Weight226.66 g/mol
Exact Mass226.05
IUPAC Name(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol
SMILESCCn1cc(C(O)c2ccc(Cl)o2)cn1
InChIInChI=1S/C10H11ClN2O2/c1-2-13-6-7(5-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3
InChIKeyZZLKHWAMVNBSEU-UHFFFAOYSA-N
XLogP2.23
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.66
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4,5-dibromofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol
CID 63893672
(2,5-dichlorothiophen-3-yl)-(1-ethylpyrazol-4-yl)methanol
CID 107969581
(3,5-dimethylphenyl)-(1-ethylpyrazol-4-yl)methanol
CID 63894378
2-amino-1-(1-ethylpyrazol-4-yl)ethanol
CID 55264385
(5-chloro-3-iodo-1-methylpyrazol-4-yl)-(1-ethylpyrazol-4-yl)methanol
CID 164719161
(4-chloro-1-propylpyrazol-5-yl)-(1-ethylpyrazol-4-yl)methanol
CID 114636989
1-(1-ethylpyrazol-4-yl)propane-1,2-diol
CID 103452757
(2,5-dimethylthiophen-3-yl)-(1-ethylpyrazol-4-yl)methanol
CID 63901362
(2,5-dimethylphenyl)-(1-ethylpyrazol-4-yl)methanol
CID 63895655
(4-cyclopropylphenyl)-(1-ethylpyrazol-4-yl)methanol
CID 79980499
methyl 5-[hydroxy-(1-propylpyrazol-4-yl)methyl]furan-2-carboxylate
CID 106946499
2-ethyl-1-(1-ethylpyrazol-4-yl)butan-1-ol
CID 63894691

Frequently Asked Questions

What is the IUPAC name of (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol?
The IUPAC name of (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol (CID 106693588) is (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol.
What is the SMILES notation for (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol?
The canonical SMILES for (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol is CCn1cc(C(O)c2ccc(Cl)o2)cn1.
What is the InChIKey of (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol?
The InChIKey is ZZLKHWAMVNBSEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2O2/c1-2-13-6-7(5-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3.
What are the key properties of (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol?
(5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol has a molecular weight of 226.66 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorofuran-2-yl)-(1-ethylpyrazol-4-yl)methanol is sourced from PubChem (CID 106693588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).