(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol

C13H17N3O2 — CID 114557064

IUPAC(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cncc(OC)c1
InChIInChI=1S/C13H17N3O2/c1-3-6-16-12(4-5-15-16)13(17)10-7-11(18-2)9-14-8-10/h4-5,7-9,13,17H,3,6H2,1-2H3
InChIKeyVXMNDIMFFAUPGA-UHFFFAOYSA-N
MW247.30 g/mol
LogP1.78
Rot. Bonds5

About (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol

(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol (PubChem CID 114557064) has the molecular formula C13H17N3O2 and a molecular weight of 247.30 g/mol. Its IUPAC name is (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
PubChem CID114557064
Molecular FormulaC13H17N3O2
Molecular Weight247.30 g/mol
Exact Mass247.13
IUPAC Name(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol
SMILESCCCn1nccc1C(O)c1cncc(OC)c1
InChIInChI=1S/C13H17N3O2/c1-3-6-16-12(4-5-15-16)13(17)10-7-11(18-2)9-14-8-10/h4-5,7-9,13,17H,3,6H2,1-2H3
InChIKeyVXMNDIMFFAUPGA-UHFFFAOYSA-N
XLogP1.78
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2-propylpyrazol-3-yl)-pyrimidin-5-ylmethanol
CID 114556923
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(3-methoxy-4-pyridinyl)-(2-propylpyrazol-3-yl)methanol
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(4-ethylphenyl)-(2-propylpyrazol-3-yl)methanol
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furan-3-yl-(2-propylpyrazol-3-yl)methanol
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(3-methoxyphenyl)-(2-propylpyrazol-3-yl)methanamine
CID 63974663
(3-methoxythiophen-2-yl)-(2-propylpyrazol-3-yl)methanol
CID 115798642
(3-bromo-4-fluorophenyl)-(2-propylpyrazol-3-yl)methanol
CID 63974840
(4-cyclopropylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 79980656
isoquinolin-4-yl-(2-propylpyrazol-3-yl)methanol
CID 104504645
1H-indol-5-yl-(2-propylpyrazol-3-yl)methanol
CID 114557062
(2,5-dimethylphenyl)-(2-propylpyrazol-3-yl)methanol
CID 63977386

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol?
The IUPAC name of (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol (CID 114557064) is (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol.
What is the SMILES notation for (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol?
The canonical SMILES for (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol is CCCn1nccc1C(O)c1cncc(OC)c1.
What is the InChIKey of (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol?
The InChIKey is VXMNDIMFFAUPGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O2/c1-3-6-16-12(4-5-15-16)13(17)10-7-11(18-2)9-14-8-10/h4-5,7-9,13,17H,3,6H2,1-2H3.
What are the key properties of (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol?
(5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol has a molecular weight of 247.30 g/mol, XLogP of 1.78, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-3-pyridinyl)-(2-propylpyrazol-3-yl)methanol is sourced from PubChem (CID 114557064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).