3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine

C15H21N5 — CID 66016187

IUPAC3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine
SMILESCCc1nn(C)c(N2CCCC2c2cccnc2)c1N
InChIInChI=1S/C15H21N5/c1-3-12-14(16)15(19(2)18-12)20-9-5-7-13(20)11-6-4-8-17-10-11/h4,6,8,10,13H,3,5,7,9,16H2,1-2H3
InChIKeyUPNZSUIAXAXQLQ-UHFFFAOYSA-N
MW271.37 g/mol
LogP2.30
Rot. Bonds3

About 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine

3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine (PubChem CID 66016187) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine.

Molecular Properties

Compound Name3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine
PubChem CID66016187
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine
SMILESCCc1nn(C)c(N2CCCC2c2cccnc2)c1N
InChIInChI=1S/C15H21N5/c1-3-12-14(16)15(19(2)18-12)20-9-5-7-13(20)11-6-4-8-17-10-11/h4,6,8,10,13H,3,5,7,9,16H2,1-2H3
InChIKeyUPNZSUIAXAXQLQ-UHFFFAOYSA-N
XLogP2.30
TPSA59.97 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-3-propan-2-yl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine
CID 66018586
3-(1-methylpyrrolidin-2-yl)pyridine;propane
CID 91386217
CID 159245541
CID 159245541
hydron;bis(3-(1-methylpyrrolidin-2-yl)pyridine)
CID 158783488
3-(1-methyl(115N)azolidin-2-yl)pyridine
CID 11126596
ethane;3-(1-methylpyrrolidin-2-yl)pyridine
CID 144528341
3-(1-methylpyrrolidin-2-yl)pyridine;zinc
CID 67468212
methanol;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174330723
zinc;3-(1-methylpyrrolidin-2-yl)pyridine;oxygen(2-)
CID 157051312
butane-1,4-diamine;3-(1-methylpyrrolidin-2-yl)pyridine
CID 174745623
N,N-dimethylmethanamine;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174560807
formamide;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 175000566

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine?
The IUPAC name of 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine (CID 66016187) is 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine.
What is the SMILES notation for 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine?
The canonical SMILES for 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine is CCc1nn(C)c(N2CCCC2c2cccnc2)c1N.
What is the InChIKey of 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine?
The InChIKey is UPNZSUIAXAXQLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c1-3-12-14(16)15(19(2)18-12)20-9-5-7-13(20)11-6-4-8-17-10-11/h4,6,8,10,13H,3,5,7,9,16H2,1-2H3.
What are the key properties of 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine?
3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine has a molecular weight of 271.37 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-methyl-5-(2-pyridin-3-ylpyrrolidin-1-yl)pyrazol-4-amine is sourced from PubChem (CID 66016187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).