2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine

C14H30N2 — CID 83226985

IUPAC2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine
SMILESCCC1CCC(C)N1C(C)(CN)CC(C)C
InChIInChI=1S/C14H30N2/c1-6-13-8-7-12(4)16(13)14(5,10-15)9-11(2)3/h11-13H,6-10,15H2,1-5H3
InChIKeyORPYGAGSORGWJR-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.01
Rot. Bonds5

About 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine

2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine (PubChem CID 83226985) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine.

Molecular Properties

Compound Name2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine
PubChem CID83226985
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine
SMILESCCC1CCC(C)N1C(C)(CN)CC(C)C
InChIInChI=1S/C14H30N2/c1-6-13-8-7-12(4)16(13)14(5,10-15)9-11(2)3/h11-13H,6-10,15H2,1-5H3
InChIKeyORPYGAGSORGWJR-UHFFFAOYSA-N
XLogP3.01
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-ethyl-5-methylpyrrolidin-1-yl)-3-(2-fluorophenyl)-2-methylpropan-1-amine
CID 114831676
2-(2-ethyl-5-methylpyrrolidin-1-yl)-2-(1-methylcyclopropyl)propan-1-amine
CID 83227173
2-(3-ethyl-4-methylpiperazin-1-yl)-2,4-dimethylpentan-1-amine
CID 55217144
2,4-dimethyl-2-(2-propylpiperidin-1-yl)pentan-1-amine
CID 83052847
1-amino-3-(2-ethyl-5-methylpyrrolidin-1-yl)-2-methylpropan-2-ol
CID 83224284
2,4-dimethyl-2-(2-methylmorpholin-4-yl)pentan-1-amine
CID 24706624
2-(2,5-dihydropyrrol-1-yl)-2,4-dimethylpentan-1-amine
CID 115310339
2-(2-ethyl-1,4-oxazepan-4-yl)-2,4-dimethylpentan-1-amine
CID 114218328
(2S)-1-(2-ethyl-5-methylpyrrolidin-1-yl)propan-2-amine
CID 103934796
2-[(2-ethyl-5-methylpyrrolidin-1-yl)methyl]-4-methylpentan-1-amine
CID 83220839
2-(3,4-dimethoxypyrrolidin-1-yl)-2,4-dimethylpentan-1-amine
CID 103531727
2,4-dimethyl-2-(4-propylpiperazin-1-yl)pentan-1-amine
CID 24705230

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine?
The IUPAC name of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine (CID 83226985) is 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine.
What is the SMILES notation for 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine?
The canonical SMILES for 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine is CCC1CCC(C)N1C(C)(CN)CC(C)C.
What is the InChIKey of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine?
The InChIKey is ORPYGAGSORGWJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-6-13-8-7-12(4)16(13)14(5,10-15)9-11(2)3/h11-13H,6-10,15H2,1-5H3.
What are the key properties of 2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine?
2-(2-ethyl-5-methylpyrrolidin-1-yl)-2,4-dimethylpentan-1-amine has a molecular weight of 226.41 g/mol, XLogP of 3.01, 5 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)-2,4-dimethylpentan-1-amine is sourced from PubChem (CID 83226985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).