2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine

C13H26N2 — CID 82768579

IUPAC2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCC1(C)CCN(CC2(C)CCCC2N)C1
InChIInChI=1S/C13H26N2/c1-12(2)7-8-15(9-12)10-13(3)6-4-5-11(13)14/h11H,4-10,14H2,1-3H3
InChIKeyYYVZFJKOXNURRW-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.24
Rot. Bonds2

About 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine

2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine (PubChem CID 82768579) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine
PubChem CID82768579
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine
SMILESCC1(C)CCN(CC2(C)CCCC2N)C1
InChIInChI=1S/C13H26N2/c1-12(2)7-8-15(9-12)10-13(3)6-4-5-11(13)14/h11H,4-10,14H2,1-3H3
InChIKeyYYVZFJKOXNURRW-UHFFFAOYSA-N
XLogP2.24
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The IUPAC name of 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine (CID 82768579) is 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine is CC1(C)CCN(CC2(C)CCCC2N)C1.
What is the InChIKey of 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
The InChIKey is YYVZFJKOXNURRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-12(2)7-8-15(9-12)10-13(3)6-4-5-11(13)14/h11H,4-10,14H2,1-3H3.
What are the key properties of 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine?
2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,3-dimethylpyrrolidin-1-yl)methyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 82768579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).