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

C11H20N4 — CID 165482552

IUPAC4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
SMILESCc1cn(CCN2CCC(C)C2)nc1N
InChIInChI=1S/C11H20N4/c1-9-3-4-14(7-9)5-6-15-8-10(2)11(12)13-15/h8-9H,3-7H2,1-2H3,(H2,12,13)
InChIKeyGRPHYRMZKIECJS-UHFFFAOYSA-N
MW208.31 g/mol
LogP1.12
Rot. Bonds3

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

4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine (PubChem CID 165482552) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine.

Molecular Properties

Compound Name4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
PubChem CID165482552
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine
SMILESCc1cn(CCN2CCC(C)C2)nc1N
InChIInChI=1S/C11H20N4/c1-9-3-4-14(7-9)5-6-15-8-10(2)11(12)13-15/h8-9H,3-7H2,1-2H3,(H2,12,13)
InChIKeyGRPHYRMZKIECJS-UHFFFAOYSA-N
XLogP1.12
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 ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The IUPAC name of 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine (CID 165482552) is 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine.
What is the SMILES notation for 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The canonical SMILES for 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine is Cc1cn(CCN2CCC(C)C2)nc1N.
What is the InChIKey of 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
The InChIKey is GRPHYRMZKIECJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-9-3-4-14(7-9)5-6-15-8-10(2)11(12)13-15/h8-9H,3-7H2,1-2H3,(H2,12,13).
What are the key properties of 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine?
4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine has a molecular weight of 208.31 g/mol, XLogP of 1.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(3-methylpyrrolidin-1-yl)ethyl]pyrazol-3-amine is sourced from PubChem (CID 165482552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).