1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine

C17H27N3 — CID 80636278

IUPAC1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnc(N2CCCC2C2CCCC2)c(C)c1
InChIInChI=1S/C17H27N3/c1-13-10-14(11-18-2)12-19-17(13)20-9-5-8-16(20)15-6-3-4-7-15/h10,12,15-16,18H,3-9,11H2,1-2H3
InChIKeyUDGUYGZUDNTQCR-UHFFFAOYSA-N
MW273.42 g/mol
LogP3.27
Rot. Bonds4

About 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine

1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine (PubChem CID 80636278) has the molecular formula C17H27N3 and a molecular weight of 273.42 g/mol. Its IUPAC name is 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine
PubChem CID80636278
Molecular FormulaC17H27N3
Molecular Weight273.42 g/mol
Exact Mass273.22
IUPAC Name1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine
SMILESCNCc1cnc(N2CCCC2C2CCCC2)c(C)c1
InChIInChI=1S/C17H27N3/c1-13-10-14(11-18-2)12-19-17(13)20-9-5-8-16(20)15-6-3-4-7-15/h10,12,15-16,18H,3-9,11H2,1-2H3
InChIKeyUDGUYGZUDNTQCR-UHFFFAOYSA-N
XLogP3.27
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.42
LogP ≤ 53.27
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)-5-methyl-3-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine (CID 80636278) is 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine is CNCc1cnc(N2CCCC2C2CCCC2)c(C)c1.
What is the InChIKey of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine?
The InChIKey is UDGUYGZUDNTQCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3/c1-13-10-14(11-18-2)12-19-17(13)20-9-5-8-16(20)15-6-3-4-7-15/h10,12,15-16,18H,3-9,11H2,1-2H3.
What are the key properties of 1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine?
1-[6-(2-cyclopentylpyrrolidin-1-yl)-5-methyl-3-pyridinyl]-N-methylmethanamine has a molecular weight of 273.42 g/mol, XLogP of 3.27, 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)-5-methyl-3-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 80636278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).