(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol

C15H19ClN2O2 — CID 114635045

IUPAC(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol
SMILESCCCn1ncc(Cl)c1C(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C15H19ClN2O2/c1-3-6-18-14(11(16)8-17-18)15(19)13-5-4-12(20-13)10-7-9(10)2/h4-5,8-10,15,19H,3,6-7H2,1-2H3
InChIKeySXJSQJKPMOERKW-UHFFFAOYSA-N
MW294.78 g/mol
LogP3.74
Rot. Bonds5

About (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol

(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol (PubChem CID 114635045) has the molecular formula C15H19ClN2O2 and a molecular weight of 294.78 g/mol. Its IUPAC name is (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol.

Molecular Properties

Compound Name(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol
PubChem CID114635045
Molecular FormulaC15H19ClN2O2
Molecular Weight294.78 g/mol
Exact Mass294.11
IUPAC Name(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol
SMILESCCCn1ncc(Cl)c1C(O)c1ccc(C2CC2C)o1
InChIInChI=1S/C15H19ClN2O2/c1-3-6-18-14(11(16)8-17-18)15(19)13-5-4-12(20-13)10-7-9(10)2/h4-5,8-10,15,19H,3,6-7H2,1-2H3
InChIKeySXJSQJKPMOERKW-UHFFFAOYSA-N
XLogP3.74
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.78
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-ethyl-4-methoxypyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol
CID 114635048
(4-chloro-1-propylpyrazol-5-yl)-(3,5-dichlorophenyl)methanol
CID 114635404
1-(4-chloro-1-propylpyrazol-5-yl)-2-cyclopropylethane-1,2-diol
CID 103456755
1-(4-chloro-1-propylpyrazol-5-yl)-2-cyclohexylethane-1,2-diol
CID 103459015
(4-chloro-1-propylpyrazol-5-yl)-(2,6-difluorophenyl)methanol
CID 114634802
(3-bromothiophen-2-yl)-(4-chloro-1-propylpyrazol-5-yl)methanol
CID 114637483
1-(4-chloro-1-propylpyrazol-5-yl)propane-1,2-diol
CID 103452617
(2-chloro-4-methylphenyl)-(4-chloro-1-propylpyrazol-5-yl)methanol
CID 106859533
(4-chloro-1-propylpyrazol-5-yl)-(3,4-dimethylphenyl)methanol
CID 114635071
(4-chloro-1-propylpyrazol-5-yl)-(1-ethylpyrazol-4-yl)methanol
CID 114636989
(4-chloro-1-propylpyrazol-5-yl)-(5-fluoro-2-pyridinyl)methanol
CID 114644772
(4-chloro-1-propylpyrazol-5-yl)-pyrimidin-4-ylmethanol
CID 114635773

Frequently Asked Questions

What is the IUPAC name of (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol?
The IUPAC name of (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol (CID 114635045) is (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol.
What is the SMILES notation for (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol?
The canonical SMILES for (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol is CCCn1ncc(Cl)c1C(O)c1ccc(C2CC2C)o1.
What is the InChIKey of (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol?
The InChIKey is SXJSQJKPMOERKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O2/c1-3-6-18-14(11(16)8-17-18)15(19)13-5-4-12(20-13)10-7-9(10)2/h4-5,8-10,15,19H,3,6-7H2,1-2H3.
What are the key properties of (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol?
(4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol has a molecular weight of 294.78 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-1-propylpyrazol-5-yl)-[5-(2-methylcyclopropyl)furan-2-yl]methanol is sourced from PubChem (CID 114635045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).