1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol

C11H18N2O — CID 103008226

IUPAC1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCC1CC1C(O)CCc1cnn(C)c1
InChIInChI=1S/C11H18N2O/c1-8-5-10(8)11(14)4-3-9-6-12-13(2)7-9/h6-8,10-11,14H,3-5H2,1-2H3
InChIKeyJRSOSZOLTZDGPV-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.37
Rot. Bonds4

About 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol

1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol (PubChem CID 103008226) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol.

Molecular Properties

Compound Name1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
PubChem CID103008226
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
SMILESCC1CC1C(O)CCc1cnn(C)c1
InChIInChI=1S/C11H18N2O/c1-8-5-10(8)11(14)4-3-9-6-12-13(2)7-9/h6-8,10-11,14H,3-5H2,1-2H3
InChIKeyJRSOSZOLTZDGPV-UHFFFAOYSA-N
XLogP1.37
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methylcyclopentyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 107193091
3-(1-methylpyrazol-4-yl)-1-(2-phenylcyclopropyl)propan-1-ol
CID 103027785
1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008489
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103027909
1-cyclopropyl-4-(1-methylpyrazol-4-yl)butan-2-ol
CID 103008389
3-(1-methylpyrazol-4-yl)-1-piperidin-2-ylpropan-1-ol
CID 106634544
2-hydroxy-4-(1-methylpyrazol-4-yl)butanal
CID 103006402
1-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103008155
6-chloro-1-(1-methylpyrazol-4-yl)hexan-3-ol
CID 103008236
4-ethoxy-1-(1-methylpyrazol-4-yl)pentan-3-ol
CID 103008145
1-cycloheptyl-4-(1-methylpyrazol-4-yl)butan-2-ol
CID 103027790
2-(1-methylpyrazol-4-yl)ethanol
CID 17028076

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The IUPAC name of 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol (CID 103008226) is 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol.
What is the SMILES notation for 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The canonical SMILES for 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol is CC1CC1C(O)CCc1cnn(C)c1.
What is the InChIKey of 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
The InChIKey is JRSOSZOLTZDGPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-8-5-10(8)11(14)4-3-9-6-12-13(2)7-9/h6-8,10-11,14H,3-5H2,1-2H3.
What are the key properties of 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol?
1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopropyl)-3-(1-methylpyrazol-4-yl)propan-1-ol is sourced from PubChem (CID 103008226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).