2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol

C9H16N2O2 — CID 114633553

IUPAC2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol
SMILESCCn1ncc(OC)c1C(C)(C)O
InChIInChI=1S/C9H16N2O2/c1-5-11-8(9(2,3)12)7(13-4)6-10-11/h6,12H,5H2,1-4H3
InChIKeySCESJZNJFAUKMJ-UHFFFAOYSA-N
MW184.24 g/mol
LogP1.14
Rot. Bonds3

About 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol

2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol (PubChem CID 114633553) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol.

Molecular Properties

Compound Name2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol
PubChem CID114633553
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol
SMILESCCn1ncc(OC)c1C(C)(C)O
InChIInChI=1S/C9H16N2O2/c1-5-11-8(9(2,3)12)7(13-4)6-10-11/h6,12H,5H2,1-4H3
InChIKeySCESJZNJFAUKMJ-UHFFFAOYSA-N
XLogP1.14
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-2-(1-ethyl-4-methoxypyrazol-5-yl)butan-2-ol
CID 114665909
2-(1-ethyl-4-methoxypyrazol-5-yl)-4-methoxybutan-2-ol
CID 114633767
1-amino-2-(1-ethyl-4-methoxypyrazol-5-yl)pentan-2-ol
CID 114637770
1-cyclopropyl-1-(1-ethyl-4-methoxypyrazol-5-yl)propan-1-ol
CID 114636126
2-(1-ethyl-4-methoxypyrazol-5-yl)-1-(4-methoxyphenyl)propan-2-ol
CID 114633955
3-(1-ethyl-4-methoxypyrazol-5-yl)-N,3-dimethylbutan-1-amine
CID 114667004
2-(1-ethyl-4-methoxypyrazol-5-yl)-1-phenylbutan-2-ol
CID 114636352
2-amino-1-(1-ethyl-4-methoxypyrazol-5-yl)-2-methylpropan-1-one
CID 114668718
1-(1-ethyl-4-methoxypyrazol-5-yl)-1-(3-fluorophenyl)propan-1-ol
CID 114872310
4-amino-2-(4-methoxy-1-propylpyrazol-5-yl)butan-2-ol
CID 114665922
2-(1-ethyl-4-methoxypyrazol-5-yl)ethanol
CID 114662423
1-(1-ethyl-4-methoxypyrazol-5-yl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 105130141

Frequently Asked Questions

What is the IUPAC name of 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol?
The IUPAC name of 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol (CID 114633553) is 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol.
What is the SMILES notation for 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol?
The canonical SMILES for 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol is CCn1ncc(OC)c1C(C)(C)O.
What is the InChIKey of 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol?
The InChIKey is SCESJZNJFAUKMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c1-5-11-8(9(2,3)12)7(13-4)6-10-11/h6,12H,5H2,1-4H3.
What are the key properties of 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol?
2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol has a molecular weight of 184.24 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethyl-4-methoxypyrazol-5-yl)propan-2-ol is sourced from PubChem (CID 114633553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).