2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one

C14H26N2O — CID 43371040

IUPAC2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one
SMILESCC(NCC1CCCC1)C(=O)N1CCCCC1
InChIInChI=1S/C14H26N2O/c1-12(15-11-13-7-3-4-8-13)14(17)16-9-5-2-6-10-16/h12-13,15H,2-11H2,1H3
InChIKeyDWSIFCHWNKGMHI-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.17
Rot. Bonds4

About 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one

2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one (PubChem CID 43371040) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one
PubChem CID43371040
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one
SMILESCC(NCC1CCCC1)C(=O)N1CCCCC1
InChIInChI=1S/C14H26N2O/c1-12(15-11-13-7-3-4-8-13)14(17)16-9-5-2-6-10-16/h12-13,15H,2-11H2,1H3
InChIKeyDWSIFCHWNKGMHI-UHFFFAOYSA-N
XLogP2.17
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one?
The IUPAC name of 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one (CID 43371040) is 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one is CC(NCC1CCCC1)C(=O)N1CCCCC1.
What is the InChIKey of 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one?
The InChIKey is DWSIFCHWNKGMHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-12(15-11-13-7-3-4-8-13)14(17)16-9-5-2-6-10-16/h12-13,15H,2-11H2,1H3.
What are the key properties of 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one?
2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one has a molecular weight of 238.37 g/mol, XLogP of 2.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethylamino)-1-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 43371040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).