2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one

C15H19N3O — CID 107331632

IUPAC2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
SMILESCCNC(C)(C)C(=O)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H19N3O/c1-4-16-15(2,3)14(19)13-10-11-17-18(13)12-8-6-5-7-9-12/h5-11,16H,4H2,1-3H3
InChIKeyOITYYGCYCZEAAS-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.44
Rot. Bonds5

About 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one

2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one (PubChem CID 107331632) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
PubChem CID107331632
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
SMILESCCNC(C)(C)C(=O)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H19N3O/c1-4-16-15(2,3)14(19)13-10-11-17-18(13)12-8-6-5-7-9-12/h5-11,16H,4H2,1-3H3
InChIKeyOITYYGCYCZEAAS-UHFFFAOYSA-N
XLogP2.44
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(diethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
CID 107330168
2-ethoxy-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
CID 107330243
2-(tert-butylamino)-1-(2-phenylpyrazol-3-yl)ethanone
CID 107331688
2-(aminomethyl)-2-ethyl-1-(2-phenylpyrazol-3-yl)butan-1-one
CID 107331719
2-ethoxy-3,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-one
CID 107330242
(3-ethyl-2-pyridinyl)-(2-phenylpyrazol-3-yl)methanone
CID 107330218
(2-phenylpyrazol-3-yl)-pyridin-2-ylmethanone
CID 107330077
2-(ethylamino)-2-methyl-N-[(1-phenylpyrazol-4-yl)methyl]propanamide
CID 62835939
3-amino-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one
CID 107331628
2-phenylpyrazole-3-carbothioamide
CID 83387115
2-phenyl-N-propylpyrazol-3-amine
CID 54170155
(1-methylimidazol-4-yl)-(2-phenylpyrazol-3-yl)methanone
CID 107977650

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one?
The IUPAC name of 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one (CID 107331632) is 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one.
What is the SMILES notation for 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one?
The canonical SMILES for 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one is CCNC(C)(C)C(=O)c1ccnn1-c1ccccc1.
What is the InChIKey of 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one?
The InChIKey is OITYYGCYCZEAAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-16-15(2,3)14(19)13-10-11-17-18(13)12-8-6-5-7-9-12/h5-11,16H,4H2,1-3H3.
What are the key properties of 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one?
2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one has a molecular weight of 257.34 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-1-(2-phenylpyrazol-3-yl)propan-1-one is sourced from PubChem (CID 107331632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).