2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine

C13H25N — CID 126634772

IUPAC2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine
SMILESCCC1NC(C2CCC(C)C2)CC1C
InChIInChI=1S/C13H25N/c1-4-12-10(3)8-13(14-12)11-6-5-9(2)7-11/h9-14H,4-8H2,1-3H3
InChIKeyMKXNAXNIZZXYON-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.20
Rot. Bonds2

About 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine

2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine (PubChem CID 126634772) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine.

Molecular Properties

Compound Name2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine
PubChem CID126634772
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine
SMILESCCC1NC(C2CCC(C)C2)CC1C
InChIInChI=1S/C13H25N/c1-4-12-10(3)8-13(14-12)11-6-5-9(2)7-11/h9-14H,4-8H2,1-3H3
InChIKeyMKXNAXNIZZXYON-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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trans-(1R,3R)-1-ethyl-3-methylcyclopentane
CID 6432281
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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine?
The IUPAC name of 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine (CID 126634772) is 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine.
What is the SMILES notation for 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine?
The canonical SMILES for 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine is CCC1NC(C2CCC(C)C2)CC1C.
What is the InChIKey of 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine?
The InChIKey is MKXNAXNIZZXYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-4-12-10(3)8-13(14-12)11-6-5-9(2)7-11/h9-14H,4-8H2,1-3H3.
What are the key properties of 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine?
2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine has a molecular weight of 195.35 g/mol, XLogP of 3.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methyl-5-(3-methylcyclopentyl)pyrrolidine is sourced from PubChem (CID 126634772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).