3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine

C12H25N3 — CID 62975820

IUPAC3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine
SMILESCCN(CC)C1(CN)CCN(C2CC2)C1
InChIInChI=1S/C12H25N3/c1-3-15(4-2)12(9-13)7-8-14(10-12)11-5-6-11/h11H,3-10,13H2,1-2H3
InChIKeyFNLAIGFLLKQWRR-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.89
Rot. Bonds5

About 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine

3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine (PubChem CID 62975820) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine
PubChem CID62975820
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine
SMILESCCN(CC)C1(CN)CCN(C2CC2)C1
InChIInChI=1S/C12H25N3/c1-3-15(4-2)12(9-13)7-8-14(10-12)11-5-6-11/h11H,3-10,13H2,1-2H3
InChIKeyFNLAIGFLLKQWRR-UHFFFAOYSA-N
XLogP0.89
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine?
The IUPAC name of 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine (CID 62975820) is 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine.
What is the SMILES notation for 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine?
The canonical SMILES for 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine is CCN(CC)C1(CN)CCN(C2CC2)C1.
What is the InChIKey of 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine?
The InChIKey is FNLAIGFLLKQWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-3-15(4-2)12(9-13)7-8-14(10-12)11-5-6-11/h11H,3-10,13H2,1-2H3.
What are the key properties of 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine?
3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine has a molecular weight of 211.35 g/mol, XLogP of 0.89, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-1-cyclopropyl-N,N-diethylpyrrolidin-3-amine is sourced from PubChem (CID 62975820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).