2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol

C10H19N3O — CID 105450996

IUPAC2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol
SMILESCc1nn(CCO)c(C)c1C(C)CN
InChIInChI=1S/C10H19N3O/c1-7(6-11)10-8(2)12-13(4-5-14)9(10)3/h7,14H,4-6,11H2,1-3H3
InChIKeyIVBOJQODSDEYJJ-UHFFFAOYSA-N
MW197.28 g/mol
LogP0.55
Rot. Bonds4

About 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol

2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol (PubChem CID 105450996) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol
PubChem CID105450996
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol
SMILESCc1nn(CCO)c(C)c1C(C)CN
InChIInChI=1S/C10H19N3O/c1-7(6-11)10-8(2)12-13(4-5-14)9(10)3/h7,14H,4-6,11H2,1-3H3
InChIKeyIVBOJQODSDEYJJ-UHFFFAOYSA-N
XLogP0.55
TPSA64.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1-tert-butyl-3,5-dimethylpyrazol-4-yl)propan-1-amine
CID 79219682
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CID 80693840
2-[4-(1-methoxyethyl)-3,5-dimethylpyrazol-1-yl]ethanamine
CID 102543541
2-(5-amino-3-propan-2-ylpyrazol-1-yl)ethanol
CID 43348896
2-[3,5-dimethyl-4-[(3-methylbutan-2-ylamino)methyl]pyrazol-1-yl]ethanol
CID 110905540
2-(4,5-diamino-3-methylpyrazol-1-yl)ethanol
CID 10197801
N-(2,2-difluoroethyl)-1-(2-hydroxyethyl)-3,5-dimethylpyrazole-4-sulfonamide
CID 115409002
2-amino-2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethanol
CID 130641286
2-[1-(2-fluorophenyl)-3,5-dimethylpyrazol-4-yl]propan-1-amine
CID 79218757
2-[1-(2,6-dimethylpyrimidin-4-yl)-3,5-dimethylpyrazol-4-yl]propan-1-amine
CID 79822255
N-[2-[3,5-dimethyl-1-(3-methylbutyl)pyrazol-4-yl]propyl]cyclopropanamine
CID 79225433
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CID 110906220

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol?
The IUPAC name of 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol (CID 105450996) is 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol?
The canonical SMILES for 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol is Cc1nn(CCO)c(C)c1C(C)CN.
What is the InChIKey of 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol?
The InChIKey is IVBOJQODSDEYJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-7(6-11)10-8(2)12-13(4-5-14)9(10)3/h7,14H,4-6,11H2,1-3H3.
What are the key properties of 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol?
2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol has a molecular weight of 197.28 g/mol, XLogP of 0.55, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-aminopropan-2-yl)-3,5-dimethylpyrazol-1-yl]ethanol is sourced from PubChem (CID 105450996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).