2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol

C15H21N3O — CID 107330353

IUPAC2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol
SMILESCN(C)C(C)(C)C(O)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H21N3O/c1-15(2,17(3)4)14(19)13-10-11-16-18(13)12-8-6-5-7-9-12/h5-11,14,19H,1-4H3
InChIKeyATUYYOQWGVKPLX-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.25
Rot. Bonds4

About 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol

2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol (PubChem CID 107330353) has the molecular formula C15H21N3O and a molecular weight of 259.35 g/mol. Its IUPAC name is 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol.

Molecular Properties

Compound Name2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol
PubChem CID107330353
Molecular FormulaC15H21N3O
Molecular Weight259.35 g/mol
Exact Mass259.17
IUPAC Name2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol
SMILESCN(C)C(C)(C)C(O)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H21N3O/c1-15(2,17(3)4)14(19)13-10-11-16-18(13)12-8-6-5-7-9-12/h5-11,14,19H,1-4H3
InChIKeyATUYYOQWGVKPLX-UHFFFAOYSA-N
XLogP2.25
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-N,2-N,2-N,2-tetramethyl-1-(2-phenylpyrazol-3-yl)propane-1,2-diamine
CID 107330721
2-(dimethylamino)-2-methyl-1-(3-phenyltriazol-4-yl)propan-1-ol
CID 114686558
2-chloro-2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330397
2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-ol
CID 107332293
2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330398
3,3,3-trifluoro-1-(2-phenylpyrazol-3-yl)propan-1-ol
CID 107330304
(2-methylcyclopropyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330350
2-(3-methylphenyl)-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330309
2-(2-phenylpyrazol-3-yl)propan-1-amine
CID 105453704
2-(ethylamino)-1-(2-phenylpyrazol-3-yl)ethanol
CID 107331439
2-methylsulfonyl-1-(2-phenylpyrazol-3-yl)ethanol
CID 107332340
N-ethyl-2,2-dimethyl-1-(2-phenylpyrazol-3-yl)propan-1-amine
CID 107330534

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol?
The IUPAC name of 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol (CID 107330353) is 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol.
What is the SMILES notation for 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol?
The canonical SMILES for 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol is CN(C)C(C)(C)C(O)c1ccnn1-c1ccccc1.
What is the InChIKey of 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol?
The InChIKey is ATUYYOQWGVKPLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O/c1-15(2,17(3)4)14(19)13-10-11-16-18(13)12-8-6-5-7-9-12/h5-11,14,19H,1-4H3.
What are the key properties of 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol?
2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol has a molecular weight of 259.35 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-ol is sourced from PubChem (CID 107330353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).