2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine

C14H28N2 — CID 83227173

IUPAC2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine
SMILESCCC1CCC(C)N1C(C)(CN)C1(C)CC1
InChIInChI=1S/C14H28N2/c1-5-12-7-6-11(2)16(12)14(4,10-15)13(3)8-9-13/h11-12H,5-10,15H2,1-4H3
InChIKeyAYFQVLIMGVXCHN-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.77
Rot. Bonds4

About 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine

2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine (PubChem CID 83227173) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine.

Molecular Properties

Compound Name2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine
PubChem CID83227173
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine
SMILESCCC1CCC(C)N1C(C)(CN)C1(C)CC1
InChIInChI=1S/C14H28N2/c1-5-12-7-6-11(2)16(12)14(4,10-15)13(3)8-9-13/h11-12H,5-10,15H2,1-4H3
InChIKeyAYFQVLIMGVXCHN-UHFFFAOYSA-N
XLogP2.77
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine?
The IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine (CID 83227173) is 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine.
What is the SMILES notation for 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine?
The canonical SMILES for 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine is CCC1CCC(C)N1C(C)(CN)C1(C)CC1.
What is the InChIKey of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine?
The InChIKey is AYFQVLIMGVXCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-5-12-7-6-11(2)16(12)14(4,10-15)13(3)8-9-13/h11-12H,5-10,15H2,1-4H3.
What are the key properties of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine?
2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine has a molecular weight of 224.39 g/mol, XLogP of 2.77, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine is sourced from PubChem (CID 83227173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).