1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol

C15H21N3O2 — CID 105121224

IUPAC1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
SMILESCOc1cncc(C(O)CCc2c(C)nn(C)c2C)c1
InChIInChI=1S/C15H21N3O2/c1-10-14(11(2)18(3)17-10)5-6-15(19)12-7-13(20-4)9-16-8-12/h7-9,15,19H,5-6H2,1-4H3
InChIKeyOMOIXOFBRABJNQ-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.11
Rot. Bonds5

About 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol

1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol (PubChem CID 105121224) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
PubChem CID105121224
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
SMILESCOc1cncc(C(O)CCc2c(C)nn(C)c2C)c1
InChIInChI=1S/C15H21N3O2/c1-10-14(11(2)18(3)17-10)5-6-15(19)12-7-13(20-4)9-16-8-12/h7-9,15,19H,5-6H2,1-4H3
InChIKeyOMOIXOFBRABJNQ-UHFFFAOYSA-N
XLogP2.11
TPSA60.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(5-fluoro-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
CID 105080417
[1-(5-methoxy-3-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethyl]hydrazine
CID 105329848
N-ethyl-1-(5-methoxy-3-pyridinyl)-2-(1,3,5-trimethylpyrazol-4-yl)ethanamine
CID 105175253
[1-(3-methoxyphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105283653
1-(3-chloro-4-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
CID 107562206
[1-(5-fluoro-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105288178
1-(1,3,5-trimethylpyrazol-4-yl)heptane-3,4-diol
CID 83930169
1-pyridin-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105098522
1-(1,5-dimethylpyrazol-3-yl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 114219334
[1-pyridin-3-yl-3-(1,3,5-trimethylpyrazol-4-yl)propyl]hydrazine
CID 105287115
1-(2,3-dihydrofuran-5-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
CID 102653938
1-(1-ethylpyrazol-4-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-amine
CID 105109199

Frequently Asked Questions

What is the IUPAC name of 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol (CID 105121224) is 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol is COc1cncc(C(O)CCc2c(C)nn(C)c2C)c1.
What is the InChIKey of 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol?
The InChIKey is OMOIXOFBRABJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-10-14(11(2)18(3)17-10)5-6-15(19)12-7-13(20-4)9-16-8-12/h7-9,15,19H,5-6H2,1-4H3.
What are the key properties of 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol?
1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol has a molecular weight of 275.35 g/mol, XLogP of 2.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methoxy-3-pyridinyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 105121224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).