3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine

C11H22N2 — CID 114547367

IUPAC3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(NCC2CCNC2)C1
InChIInChI=1S/C11H22N2/c1-9-2-3-11(6-9)13-8-10-4-5-12-7-10/h9-13H,2-8H2,1H3
InChIKeyDBEBMKXPIKMUNT-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.37
Rot. Bonds3

About 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine

3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine (PubChem CID 114547367) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine
PubChem CID114547367
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine
SMILESCC1CCC(NCC2CCNC2)C1
InChIInChI=1S/C11H22N2/c1-9-2-3-11(6-9)13-8-10-4-5-12-7-10/h9-13H,2-8H2,1H3
InChIKeyDBEBMKXPIKMUNT-UHFFFAOYSA-N
XLogP1.37
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine?
The IUPAC name of 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine (CID 114547367) is 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine?
The canonical SMILES for 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine is CC1CCC(NCC2CCNC2)C1.
What is the InChIKey of 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine?
The InChIKey is DBEBMKXPIKMUNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9-2-3-11(6-9)13-8-10-4-5-12-7-10/h9-13H,2-8H2,1H3.
What are the key properties of 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine?
3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(pyrrolidin-3-ylmethyl)cyclopentan-1-amine is sourced from PubChem (CID 114547367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).