4,4-diethylpyrrolidin-3-amine

C8H18N2 — CID 149278511

IUPAC4,4-diethylpyrrolidin-3-amine
SMILESCCC1(CC)CNCC1N
InChIInChI=1S/C8H18N2/c1-3-8(4-2)6-10-5-7(8)9/h7,10H,3-6,9H2,1-2H3
InChIKeyXSMKRZGEWSYFJA-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.72
Rot. Bonds2

About 4,4-diethylpyrrolidin-3-amine

4,4-diethylpyrrolidin-3-amine (PubChem CID 149278511) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 4,4-diethylpyrrolidin-3-amine.

Molecular Properties

Compound Name4,4-diethylpyrrolidin-3-amine
PubChem CID149278511
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name4,4-diethylpyrrolidin-3-amine
SMILESCCC1(CC)CNCC1N
InChIInChI=1S/C8H18N2/c1-3-8(4-2)6-10-5-7(8)9/h7,10H,3-6,9H2,1-2H3
InChIKeyXSMKRZGEWSYFJA-UHFFFAOYSA-N
XLogP0.72
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4,4-diethylpyrrolidin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4-dipropylpyrrolidin-3-amine
CID 165454164
4,4-diethylpyrrolidine-3-carboxylic acid
CID 63939611
ethane;4-ethyl-3,3-difluoropyrrolidine
CID 177028431
(3,3-diethylpiperidin-4-yl)methanol
CID 84654170
(3S,4S)-4-amino-3-propylpyrrolidine-3-carboxylic acid
CID 130762276
(4S)-4-(4-bromophenyl)-3,3-diethylpyrrolidine
CID 125450649
5-azaspiro[2.4]heptan-7-amine;dihydrochloride
CID 22033764
(3R)-4,4-difluoropyrrolidin-3-amine;hydrochloride
CID 170923039
2-[(3S)-4,4-diethylpyrrolidin-3-yl]phenol
CID 125450658
5-ethyl-2,7-diazaspiro[3.4]octane
CID 168914413
2,2-diethylcyclopentan-1-amine
CID 165447049
(4S)-3,3-diethyl-4-(3-methylphenyl)pyrrolidine
CID 125450470

Frequently Asked Questions

What is the IUPAC name of 4,4-diethylpyrrolidin-3-amine?
The IUPAC name of 4,4-diethylpyrrolidin-3-amine (CID 149278511) is 4,4-diethylpyrrolidin-3-amine.
What is the SMILES notation for 4,4-diethylpyrrolidin-3-amine?
The canonical SMILES for 4,4-diethylpyrrolidin-3-amine is CCC1(CC)CNCC1N.
What is the InChIKey of 4,4-diethylpyrrolidin-3-amine?
The InChIKey is XSMKRZGEWSYFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-3-8(4-2)6-10-5-7(8)9/h7,10H,3-6,9H2,1-2H3.
What are the key properties of 4,4-diethylpyrrolidin-3-amine?
4,4-diethylpyrrolidin-3-amine has a molecular weight of 142.25 g/mol, XLogP of 0.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4-diethylpyrrolidin-3-amine is sourced from PubChem (CID 149278511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).