3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine

C15H24N2O — CID 105025992

IUPAC3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CCCC1)c1cncc(OC)c1
InChIInChI=1S/C15H24N2O/c1-16-15(8-7-12-5-3-4-6-12)13-9-14(18-2)11-17-10-13/h9-12,15-16H,3-8H2,1-2H3
InChIKeyQSMADIIWSHUGCL-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.32
Rot. Bonds6

About 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine

3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine (PubChem CID 105025992) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine
PubChem CID105025992
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine
SMILESCNC(CCC1CCCC1)c1cncc(OC)c1
InChIInChI=1S/C15H24N2O/c1-16-15(8-7-12-5-3-4-6-12)13-9-14(18-2)11-17-10-13/h9-12,15-16H,3-8H2,1-2H3
InChIKeyQSMADIIWSHUGCL-UHFFFAOYSA-N
XLogP3.32
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The IUPAC name of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine (CID 105025992) is 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine.
What is the SMILES notation for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The canonical SMILES for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine is CNC(CCC1CCCC1)c1cncc(OC)c1.
What is the InChIKey of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
The InChIKey is QSMADIIWSHUGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-16-15(8-7-12-5-3-4-6-12)13-9-14(18-2)11-17-10-13/h9-12,15-16H,3-8H2,1-2H3.
What are the key properties of 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine?
3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine has a molecular weight of 248.37 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-(5-methoxy-3-pyridinyl)-N-methylpropan-1-amine is sourced from PubChem (CID 105025992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).