1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine

C13H21N5 — CID 105167093

IUPAC1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCc1cc(C(N)Cc2nccn2C)n(CC)n1
InChIInChI=1S/C13H21N5/c1-4-10-8-12(18(5-2)16-10)11(14)9-13-15-6-7-17(13)3/h6-8,11H,4-5,9,14H2,1-3H3
InChIKeyBBZYPPRULWNZSD-UHFFFAOYSA-N
MW247.35 g/mol
LogP1.44
Rot. Bonds5

About 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine

1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine (PubChem CID 105167093) has the molecular formula C13H21N5 and a molecular weight of 247.35 g/mol. Its IUPAC name is 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine.

Molecular Properties

Compound Name1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine
PubChem CID105167093
Molecular FormulaC13H21N5
Molecular Weight247.35 g/mol
Exact Mass247.18
IUPAC Name1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine
SMILESCCc1cc(C(N)Cc2nccn2C)n(CC)n1
InChIInChI=1S/C13H21N5/c1-4-10-8-12(18(5-2)16-10)11(14)9-13-15-6-7-17(13)3/h6-8,11H,4-5,9,14H2,1-3H3
InChIKeyBBZYPPRULWNZSD-UHFFFAOYSA-N
XLogP1.44
TPSA61.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.35
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(1,3-diethylpyrazol-5-yl)-2-(1-propan-2-ylpyrazol-3-yl)ethanamine
CID 105154827
1-(3-ethyl-1-methylpyrazol-4-yl)-2-(1-methylimidazol-2-yl)ethanamine
CID 102812630
[(1,3-diethylpyrazol-5-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105307646
2-(1-methylimidazol-2-yl)-1-(1-methylpyrazol-3-yl)ethanamine
CID 79760474
1-(3,5-dichlorophenyl)-2-(1-methylimidazol-2-yl)ethanamine
CID 115580385
1-(3-ethyl-1-methylpyrazol-5-yl)-3-(1-methylimidazol-2-yl)-N-propylpropan-1-amine
CID 105187793
1-(4-ethylthiadiazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine
CID 105167023
3-ethyl-1-(1-methylimidazol-2-yl)pentan-2-amine
CID 115580390
1,3-diethyl-5-propan-2-ylpyrazole
CID 118564106
2-(1-methylimidazol-2-yl)-1-(2-methyl-4-pyridinyl)ethanamine
CID 106755605
1-(1,3-diethylpyrazol-5-yl)-3-phenylpropan-1-amine
CID 105093971
(3-ethyl-1-methylpyrazol-5-yl)-(1-methylimidazol-2-yl)methanol
CID 105098896

Frequently Asked Questions

What is the IUPAC name of 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine?
The IUPAC name of 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine (CID 105167093) is 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine.
What is the SMILES notation for 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine?
The canonical SMILES for 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine is CCc1cc(C(N)Cc2nccn2C)n(CC)n1.
What is the InChIKey of 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine?
The InChIKey is BBZYPPRULWNZSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N5/c1-4-10-8-12(18(5-2)16-10)11(14)9-13-15-6-7-17(13)3/h6-8,11H,4-5,9,14H2,1-3H3.
What are the key properties of 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine?
1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine has a molecular weight of 247.35 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-diethylpyrazol-5-yl)-2-(1-methylimidazol-2-yl)ethanamine is sourced from PubChem (CID 105167093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).