1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine

C16H25N3 — CID 62294232

IUPAC1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(N2CCCC2C2CCCC2)n1
InChIInChI=1S/C16H25N3/c1-17-12-14-8-4-10-16(18-14)19-11-5-9-15(19)13-6-2-3-7-13/h4,8,10,13,15,17H,2-3,5-7,9,11-12H2,1H3
InChIKeyCXDOLJUZKSNQGT-UHFFFAOYSA-N
MW259.40 g/mol
LogP2.96
Rot. Bonds4

About 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine

1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine (PubChem CID 62294232) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine
PubChem CID62294232
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(N2CCCC2C2CCCC2)n1
InChIInChI=1S/C16H25N3/c1-17-12-14-8-4-10-16(18-14)19-11-5-9-15(19)13-6-2-3-7-13/h4,8,10,13,15,17H,2-3,5-7,9,11-12H2,1H3
InChIKeyCXDOLJUZKSNQGT-UHFFFAOYSA-N
XLogP2.96
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine (CID 62294232) is 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine is CNCc1cccc(N2CCCC2C2CCCC2)n1.
What is the InChIKey of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The InChIKey is CXDOLJUZKSNQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-17-12-14-8-4-10-16(18-14)19-11-5-9-15(19)13-6-2-3-7-13/h4,8,10,13,15,17H,2-3,5-7,9,11-12H2,1H3.
What are the key properties of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine?
1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine has a molecular weight of 259.40 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62294232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).