2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine

C17H24N4 — CID 60974191

IUPAC2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine
SMILESCCC1CCCN1C(CN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C17H24N4/c1-2-15-9-6-10-20(15)17(11-18)14-12-19-21(13-14)16-7-4-3-5-8-16/h3-5,7-8,12-13,15,17H,2,6,9-11,18H2,1H3
InChIKeyHGWDSTDGMBHEFC-UHFFFAOYSA-N
MW284.41 g/mol
LogP2.75
Rot. Bonds5

About 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine

2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine (PubChem CID 60974191) has the molecular formula C17H24N4 and a molecular weight of 284.41 g/mol. Its IUPAC name is 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine
PubChem CID60974191
Molecular FormulaC17H24N4
Molecular Weight284.41 g/mol
Exact Mass284.20
IUPAC Name2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine
SMILESCCC1CCCN1C(CN)c1cnn(-c2ccccc2)c1
InChIInChI=1S/C17H24N4/c1-2-15-9-6-10-20(15)17(11-18)14-12-19-21(13-14)16-7-4-3-5-8-16/h3-5,7-8,12-13,15,17H,2,6,9-11,18H2,1H3
InChIKeyHGWDSTDGMBHEFC-UHFFFAOYSA-N
XLogP2.75
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.41
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethylpiperidin-1-yl)-2-phenylethanamine
CID 43266409
2-(2-ethylpiperidin-1-yl)-2-pyridin-3-ylethanamine
CID 43266319
2-(2-ethylpyrrolidin-1-yl)-2-(2-fluorophenyl)ethanamine
CID 60974674
2-(2-ethylpyrrolidin-1-yl)-2-(3-propylimidazol-4-yl)ethanamine
CID 66130403
2-(2-ethylpiperidin-1-yl)-2-(4-propan-2-ylphenyl)ethanamine
CID 43266345
2-(2-ethylpyrrolidin-1-yl)-2-(3,4,5-trifluorophenyl)ethanamine
CID 63052117
2-(2,6-dichlorophenyl)-2-(2-ethylpyrrolidin-1-yl)ethanamine
CID 54882963
2-(2-propylpiperidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine
CID 103571978
2-[4-(difluoromethyl)phenyl]-2-(2-ethylazepan-1-yl)ethanamine
CID 104689206
2-(4-cyclopropylphenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
CID 79984560
2-(3-bromophenyl)-2-(2-ethylpiperidin-1-yl)ethanamine
CID 43266358
1-[1-[1-(1-phenylpyrazol-4-yl)ethyl]pyrrolidin-3-yl]ethanamine
CID 103975704

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine?
The IUPAC name of 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine (CID 60974191) is 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine?
The canonical SMILES for 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine is CCC1CCCN1C(CN)c1cnn(-c2ccccc2)c1.
What is the InChIKey of 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine?
The InChIKey is HGWDSTDGMBHEFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4/c1-2-15-9-6-10-20(15)17(11-18)14-12-19-21(13-14)16-7-4-3-5-8-16/h3-5,7-8,12-13,15,17H,2,6,9-11,18H2,1H3.
What are the key properties of 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine?
2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine has a molecular weight of 284.41 g/mol, XLogP of 2.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpyrrolidin-1-yl)-2-(1-phenylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 60974191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).