2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine

C11H23N — CID 168836528

IUPAC2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine
SMILESCC1CC(CCN(C)C)CC1C
InChIInChI=1S/C11H23N/c1-9-7-11(8-10(9)2)5-6-12(3)4/h9-11H,5-8H2,1-4H3
InChIKeyVVEWNZAFOVGYOL-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.62
Rot. Bonds3

About 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine

2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine (PubChem CID 168836528) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine
PubChem CID168836528
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine
SMILESCC1CC(CCN(C)C)CC1C
InChIInChI=1S/C11H23N/c1-9-7-11(8-10(9)2)5-6-12(3)4/h9-11H,5-8H2,1-4H3
InChIKeyVVEWNZAFOVGYOL-UHFFFAOYSA-N
XLogP2.62
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine?
The IUPAC name of 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine (CID 168836528) is 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine is CC1CC(CCN(C)C)CC1C.
What is the InChIKey of 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine?
The InChIKey is VVEWNZAFOVGYOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-9-7-11(8-10(9)2)5-6-12(3)4/h9-11H,5-8H2,1-4H3.
What are the key properties of 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine?
2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine has a molecular weight of 169.31 g/mol, XLogP of 2.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylcyclopentyl)-N,N-dimethylethanamine is sourced from PubChem (CID 168836528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).