(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol

C16H20N2O — CID 79980656

IUPAC(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccc(C2CC2)cc1
InChIInChI=1S/C16H20N2O/c1-2-11-18-15(9-10-17-18)16(19)14-7-5-13(6-8-14)12-3-4-12/h5-10,12,16,19H,2-4,11H2,1H3
InChIKeyOTIZLZPUCVZQBB-UHFFFAOYSA-N
MW256.35 g/mol
LogP3.25
Rot. Bonds5

About (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol

(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol (PubChem CID 79980656) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol
PubChem CID79980656
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1ccc(C2CC2)cc1
InChIInChI=1S/C16H20N2O/c1-2-11-18-15(9-10-17-18)16(19)14-7-5-13(6-8-14)12-3-4-12/h5-10,12,16,19H,2-4,11H2,1H3
InChIKeyOTIZLZPUCVZQBB-UHFFFAOYSA-N
XLogP3.25
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-ethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63976106
(2-propylpyrazol-3-yl)-pyrimidin-5-ylmethanol
CID 114556923
furan-3-yl-(2-propylpyrazol-3-yl)methanol
CID 63974629
(3-fluoro-4-methoxyphenyl)-(2-propylpyrazol-3-yl)methanol
CID 65100970
(4-cyclobutylphenyl)-(3-propylimidazol-4-yl)methanol
CID 116505404
(3-bromo-4-fluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63974840
(4-chloro-1-ethylpyrazol-5-yl)-(4-cyclopropylphenyl)methanol
CID 114636929
1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
CID 114557062
(2-ethylpyrazol-3-yl)-(4-propylphenyl)methanol
CID 114556918
(4-cyclopropylphenyl)-(1-ethylpyrazol-4-yl)methanol
CID 79980499
(3-methoxythiophen-2-yl)-(2-propylpyrazol-3-yl)methanol
CID 115798642
(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
CID 114557064

Frequently Asked Questions

What is the IUPAC name of (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol (CID 79980656) is (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1ccc(C2CC2)cc1.
What is the InChIKey of (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol?
The InChIKey is OTIZLZPUCVZQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-2-11-18-15(9-10-17-18)16(19)14-7-5-13(6-8-14)12-3-4-12/h5-10,12,16,19H,2-4,11H2,1H3.
What are the key properties of (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol?
(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol has a molecular weight of 256.35 g/mol, XLogP of 3.25, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 79980656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).