1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine

C11H20N4 — CID 103575226

IUPAC1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine
SMILESCCn1nccc1CN1CC(C)C(N)C1
InChIInChI=1S/C11H20N4/c1-3-15-10(4-5-13-15)7-14-6-9(2)11(12)8-14/h4-5,9,11H,3,6-8,12H2,1-2H3
InChIKeyGDNBOWCMEZUAFC-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.68
Rot. Bonds3

About 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine

1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine (PubChem CID 103575226) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine
PubChem CID103575226
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine
SMILESCCn1nccc1CN1CC(C)C(N)C1
InChIInChI=1S/C11H20N4/c1-3-15-10(4-5-13-15)7-14-6-9(2)11(12)8-14/h4-5,9,11H,3,6-8,12H2,1-2H3
InChIKeyGDNBOWCMEZUAFC-UHFFFAOYSA-N
XLogP0.68
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-5-[(3-methylazetidin-1-yl)methyl]pyrazole
CID 130719022
1-[(2-ethylpyrazol-3-yl)methyl]-5-methylpiperidin-3-amine
CID 114556413
(3R)-1-[(2-ethylpyrazol-3-yl)methyl]-3-methylpiperazine
CID 103885908
[(3R,4R)-1-[(2-ethylpyrazol-3-yl)methyl]-4-phenylpyrrolidin-3-yl]methanamine;hydrochloride
CID 120769405
(3S)-1-[(2-ethylpyrazol-3-yl)methyl]pyrrolidin-3-ol
CID 103882977
1-[1-[(2-ethylpyrazol-3-yl)methyl]piperidin-4-yl]ethanamine
CID 113499860
1-[(1-ethylindazol-3-yl)methyl]-4-methylpyrrolidin-3-amine
CID 103577247
6-[(2-ethylpyrazol-3-yl)methyl]-1,2,3,4,4a,5,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102678285
[(3S,4R)-1-[(2-ethylpyrazol-3-yl)methyl]-4-(1-propan-2-ylpyrazol-4-yl)pyrrolidin-3-yl]methanol
CID 120949469
4-methyl-1-[(4-pyrazol-1-ylphenyl)methyl]pyrrolidin-3-amine
CID 103576557
1-[(2-ethylpyrazol-3-yl)methyl]-2,5-dimethylpiperazine;hydrochloride
CID 120906038
1-[(4-fluorophenyl)methyl]-4-methylpyrrolidin-3-amine
CID 103575513

Frequently Asked Questions

What is the IUPAC name of 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine?
The IUPAC name of 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine (CID 103575226) is 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine.
What is the SMILES notation for 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine?
The canonical SMILES for 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine is CCn1nccc1CN1CC(C)C(N)C1.
What is the InChIKey of 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine?
The InChIKey is GDNBOWCMEZUAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-3-15-10(4-5-13-15)7-14-6-9(2)11(12)8-14/h4-5,9,11H,3,6-8,12H2,1-2H3.
What are the key properties of 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine?
1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine has a molecular weight of 208.31 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-ethylpyrazol-3-yl)methyl]-4-methylpyrrolidin-3-amine is sourced from PubChem (CID 103575226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).