2-ethyl-2-(2-ethylhexyl)pyrrolidine

C14H29N — CID 66468510

IUPAC2-ethyl-2-(2-ethylhexyl)pyrrolidine
SMILESCCCCC(CC)CC1(CC)CCCN1
InChIInChI=1S/C14H29N/c1-4-7-9-13(5-2)12-14(6-3)10-8-11-15-14/h13,15H,4-12H2,1-3H3
InChIKeyUMPNKXQPAPLLGT-UHFFFAOYSA-N
MW211.39 g/mol
LogP4.13
Rot. Bonds7

About 2-ethyl-2-(2-ethylhexyl)pyrrolidine

2-ethyl-2-(2-ethylhexyl)pyrrolidine (PubChem CID 66468510) has the molecular formula C14H29N and a molecular weight of 211.39 g/mol. Its IUPAC name is 2-ethyl-2-(2-ethylhexyl)pyrrolidine.

Molecular Properties

Compound Name2-ethyl-2-(2-ethylhexyl)pyrrolidine
PubChem CID66468510
Molecular FormulaC14H29N
Molecular Weight211.39 g/mol
Exact Mass211.23
IUPAC Name2-ethyl-2-(2-ethylhexyl)pyrrolidine
SMILESCCCCC(CC)CC1(CC)CCCN1
InChIInChI=1S/C14H29N/c1-4-7-9-13(5-2)12-14(6-3)10-8-11-15-14/h13,15H,4-12H2,1-3H3
InChIKeyUMPNKXQPAPLLGT-UHFFFAOYSA-N
XLogP4.13
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.39
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-ethyl-2-(2-methylpentyl)pyrrolidine
CID 66466921
2-butyl-2-(2-methylpropyl)pyrrolidine
CID 66467900
2,2-dipropylpyrrolidine
CID 13332418
2-butyl-2-hexylpyrrolidine
CID 174534205
1-(2-ethylhexyl)cyclopropan-1-amine
CID 66024000
1-(2-ethylhexyl)cycloheptan-1-ol
CID 63406622
2-ethyl-2-pentylazepane
CID 79116798
1-(2-ethylhexyl)cyclohexan-1-ol
CID 63409044
3-(2-ethylhexyl)pyrrolidin-3-ol
CID 63587547
[1-(2-ethylhexyl)cyclohexyl]methanamine
CID 63522503
2-ethylhexyl 2-propylpyrrolidine-2-carboxylate
CID 106978103
1-(2-ethylhexyl)-1,2,2-trimethylcyclopropane
CID 123492953

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(2-ethylhexyl)pyrrolidine?
The IUPAC name of 2-ethyl-2-(2-ethylhexyl)pyrrolidine (CID 66468510) is 2-ethyl-2-(2-ethylhexyl)pyrrolidine.
What is the SMILES notation for 2-ethyl-2-(2-ethylhexyl)pyrrolidine?
The canonical SMILES for 2-ethyl-2-(2-ethylhexyl)pyrrolidine is CCCCC(CC)CC1(CC)CCCN1.
What is the InChIKey of 2-ethyl-2-(2-ethylhexyl)pyrrolidine?
The InChIKey is UMPNKXQPAPLLGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N/c1-4-7-9-13(5-2)12-14(6-3)10-8-11-15-14/h13,15H,4-12H2,1-3H3.
What are the key properties of 2-ethyl-2-(2-ethylhexyl)pyrrolidine?
2-ethyl-2-(2-ethylhexyl)pyrrolidine has a molecular weight of 211.39 g/mol, XLogP of 4.13, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(2-ethylhexyl)pyrrolidine is sourced from PubChem (CID 66468510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).