2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol

C10H18N2O — CID 83388208

IUPAC2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol
SMILESCC(C)C(O)c1ccnn1C(C)C
InChIInChI=1S/C10H18N2O/c1-7(2)10(13)9-5-6-11-12(9)8(3)4/h5-8,10,13H,1-4H3
InChIKeyHMXBGXMVXLGFNQ-UHFFFAOYSA-N
MW182.27 g/mol
LogP2.15
Rot. Bonds3

About 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol

2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol (PubChem CID 83388208) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol
PubChem CID83388208
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol
SMILESCC(C)C(O)c1ccnn1C(C)C
InChIInChI=1S/C10H18N2O/c1-7(2)10(13)9-5-6-11-12(9)8(3)4/h5-8,10,13H,1-4H3
InChIKeyHMXBGXMVXLGFNQ-UHFFFAOYSA-N
XLogP2.15
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol
CID 112709526
3-(2-propan-2-ylpyrazol-3-yl)butan-2-ol
CID 130479931
5-(1-chloro-2-methylpropyl)-1-propan-2-ylpyrazole
CID 130480114
N-methyl-2-(2-propan-2-ylpyrazol-3-yl)propan-1-amine
CID 105439687
(5-bromo-2-chlorophenyl)-(2-propan-2-ylpyrazol-3-yl)methanol
CID 114197513
2-methyl-1-(2-propan-2-ylpyrazol-3-yl)-2-pyrrolidin-1-ylpropan-1-ol
CID 114197587
(3-chloro-2-fluorophenyl)-(2-propan-2-ylpyrazol-3-yl)methanol
CID 114197501
1-(2-propan-2-ylpyrazol-3-yl)-3-pyridin-3-ylpropan-1-ol
CID 114198081
2-(2-propan-2-ylpyrazol-3-yl)propan-2-ol
CID 83384729
N-ethyl-2-methoxy-3-methyl-1-(2-propan-2-ylpyrazol-3-yl)butan-1-amine
CID 114197724
2-propan-2-ylpyrazole-3-carboxylate
CID 7276397
2-(5-bromopyrazol-1-yl)propanoic acid
CID 122170343

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol?
The IUPAC name of 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol (CID 83388208) is 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol.
What is the SMILES notation for 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol?
The canonical SMILES for 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol is CC(C)C(O)c1ccnn1C(C)C.
What is the InChIKey of 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol?
The InChIKey is HMXBGXMVXLGFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-7(2)10(13)9-5-6-11-12(9)8(3)4/h5-8,10,13H,1-4H3.
What are the key properties of 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol?
2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol has a molecular weight of 182.27 g/mol, XLogP of 2.15, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-propan-2-ylpyrazol-3-yl)propan-1-ol is sourced from PubChem (CID 83388208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).