3-(4-methoxypyrazol-1-yl)propan-1-ol

C7H12N2O2 — CID 130511177

IUPAC3-(4-methoxypyrazol-1-yl)propan-1-ol
SMILESCOc1cnn(CCCO)c1
InChIInChI=1S/C7H12N2O2/c1-11-7-5-8-9(6-7)3-2-4-10/h5-6,10H,2-4H2,1H3
InChIKeyAEMVEXWNJWUDIU-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.27
Rot. Bonds4

About 3-(4-methoxypyrazol-1-yl)propan-1-ol

3-(4-methoxypyrazol-1-yl)propan-1-ol (PubChem CID 130511177) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 3-(4-methoxypyrazol-1-yl)propan-1-ol.

Molecular Properties

Compound Name3-(4-methoxypyrazol-1-yl)propan-1-ol
PubChem CID130511177
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name3-(4-methoxypyrazol-1-yl)propan-1-ol
SMILESCOc1cnn(CCCO)c1
InChIInChI=1S/C7H12N2O2/c1-11-7-5-8-9(6-7)3-2-4-10/h5-6,10H,2-4H2,1H3
InChIKeyAEMVEXWNJWUDIU-UHFFFAOYSA-N
XLogP0.27
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 107705463
3-[4-(4-methoxyphenoxy)pyrazol-1-yl]propan-1-amine
CID 115055561
3-[4-(difluoromethyl)pyrazol-1-yl]propan-1-ol
CID 134820997
1-(4-methoxypyrazol-1-yl)hexan-2-ol
CID 166450682
4-methoxy-1-(oxiran-2-ylmethyl)pyrazole
CID 130511286
3-[3-(4-methoxyphenyl)-1,2,4-triazol-1-yl]propan-1-ol
CID 141010071
1-(3-chloropropyl)-4-(4-methoxyphenyl)pyrazole
CID 22715717
2-[4-(4-methoxy-2-methylphenyl)pyrazol-1-yl]ethanol
CID 56716387
2-[4-[(3,5-dimethoxyphenyl)methylamino]pyrazol-1-yl]ethanol
CID 110928974
4-[4-(4-methoxyphenyl)pyrazol-1-yl]butanoic acid
CID 139033660
N-(1-ethoxy-3-methylbutan-2-yl)-1-(3-hydroxypropyl)pyrazole-4-sulfonamide
CID 106002543
2-[4-[(4-methoxyphenyl)methylamino]pyrazol-1-yl]ethanol;hydrochloride
CID 126965409

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxypyrazol-1-yl)propan-1-ol?
The IUPAC name of 3-(4-methoxypyrazol-1-yl)propan-1-ol (CID 130511177) is 3-(4-methoxypyrazol-1-yl)propan-1-ol.
What is the SMILES notation for 3-(4-methoxypyrazol-1-yl)propan-1-ol?
The canonical SMILES for 3-(4-methoxypyrazol-1-yl)propan-1-ol is COc1cnn(CCCO)c1.
What is the InChIKey of 3-(4-methoxypyrazol-1-yl)propan-1-ol?
The InChIKey is AEMVEXWNJWUDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-11-7-5-8-9(6-7)3-2-4-10/h5-6,10H,2-4H2,1H3.
What are the key properties of 3-(4-methoxypyrazol-1-yl)propan-1-ol?
3-(4-methoxypyrazol-1-yl)propan-1-ol has a molecular weight of 156.19 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxypyrazol-1-yl)propan-1-ol is sourced from PubChem (CID 130511177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).