1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine

C11H22N2 — CID 130667085

IUPAC1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine
SMILESCCN(C)C1CN(C2CC2)CC1C
InChIInChI=1S/C11H22N2/c1-4-12(3)11-8-13(7-9(11)2)10-5-6-10/h9-11H,4-8H2,1-3H3
InChIKeyJTHOYUNERGKRCH-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.42
Rot. Bonds3

About 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine

1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine (PubChem CID 130667085) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine
PubChem CID130667085
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine
SMILESCCN(C)C1CN(C2CC2)CC1C
InChIInChI=1S/C11H22N2/c1-4-12(3)11-8-13(7-9(11)2)10-5-6-10/h9-11H,4-8H2,1-3H3
InChIKeyJTHOYUNERGKRCH-UHFFFAOYSA-N
XLogP1.42
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine?
The IUPAC name of 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine (CID 130667085) is 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine.
What is the SMILES notation for 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine?
The canonical SMILES for 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine is CCN(C)C1CN(C2CC2)CC1C.
What is the InChIKey of 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine?
The InChIKey is JTHOYUNERGKRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-4-12(3)11-8-13(7-9(11)2)10-5-6-10/h9-11H,4-8H2,1-3H3.
What are the key properties of 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine?
1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine has a molecular weight of 182.31 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-ethyl-N,4-dimethylpyrrolidin-3-amine is sourced from PubChem (CID 130667085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).