(2R,3R)-1,2-diethylpyrrolidin-3-amine

C8H18N2 — CID 57321397

IUPAC(2R,3R)-1,2-diethylpyrrolidin-3-amine
SMILESCC[C@@H]1[C@H](N)CCN1CC
InChIInChI=1S/C8H18N2/c1-3-8-7(9)5-6-10(8)4-2/h7-8H,3-6,9H2,1-2H3/t7-,8-/m1/s1
InChIKeyBNOYCDQDTWFSTL-HTQZYQBOSA-N
MW142.25 g/mol
LogP0.82
Rot. Bonds2

About (2R,3R)-1,2-diethylpyrrolidin-3-amine

(2R,3R)-1,2-diethylpyrrolidin-3-amine (PubChem CID 57321397) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is (2R,3R)-1,2-diethylpyrrolidin-3-amine.

Molecular Properties

Compound Name(2R,3R)-1,2-diethylpyrrolidin-3-amine
PubChem CID57321397
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name(2R,3R)-1,2-diethylpyrrolidin-3-amine
SMILESCC[C@@H]1[C@H](N)CCN1CC
InChIInChI=1S/C8H18N2/c1-3-8-7(9)5-6-10(8)4-2/h7-8H,3-6,9H2,1-2H3/t7-,8-/m1/s1
InChIKeyBNOYCDQDTWFSTL-HTQZYQBOSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2R,3R)-1,2-diethylpyrrolidin-3-amine?
The IUPAC name of (2R,3R)-1,2-diethylpyrrolidin-3-amine (CID 57321397) is (2R,3R)-1,2-diethylpyrrolidin-3-amine.
What is the SMILES notation for (2R,3R)-1,2-diethylpyrrolidin-3-amine?
The canonical SMILES for (2R,3R)-1,2-diethylpyrrolidin-3-amine is CC[C@@H]1[C@H](N)CCN1CC.
What is the InChIKey of (2R,3R)-1,2-diethylpyrrolidin-3-amine?
The InChIKey is BNOYCDQDTWFSTL-HTQZYQBOSA-N. The full InChI is InChI=1S/C8H18N2/c1-3-8-7(9)5-6-10(8)4-2/h7-8H,3-6,9H2,1-2H3/t7-,8-/m1/s1.
What are the key properties of (2R,3R)-1,2-diethylpyrrolidin-3-amine?
(2R,3R)-1,2-diethylpyrrolidin-3-amine has a molecular weight of 142.25 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-1,2-diethylpyrrolidin-3-amine is sourced from PubChem (CID 57321397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).