1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one

C14H26N2O — CID 83997840

IUPAC1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCCC(NCC2CCCC2)C1
InChIInChI=1S/C14H26N2O/c1-2-14(17)16-9-5-8-13(11-16)15-10-12-6-3-4-7-12/h12-13,15H,2-11H2,1H3
InChIKeyBPPXMMFRIDQEGJ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.17
Rot. Bonds4

About 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one

1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one (PubChem CID 83997840) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one
PubChem CID83997840
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one
SMILESCCC(=O)N1CCCC(NCC2CCCC2)C1
InChIInChI=1S/C14H26N2O/c1-2-14(17)16-9-5-8-13(11-16)15-10-12-6-3-4-7-12/h12-13,15H,2-11H2,1H3
InChIKeyBPPXMMFRIDQEGJ-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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Related Compounds

methyl 3-(cyclopentylmethylamino)piperidine-1-carboxylate
CID 83997762
1-[(3S)-3-(methylamino)piperidin-1-yl]propan-1-one
CID 94475711
1-[3-(cyclohexylmethylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 83998592
1-[3-(cyclopentylmethylamino)pyrrolidin-1-yl]ethanone
CID 115908114
methyl 2-[5-(cyclohexylmethylamino)-1-propanoylpiperidin-3-yl]acetate
CID 83998544
1-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]propan-1-one
CID 63241729
2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119260330
methyl 2-[3-(cyclopentylmethylamino)piperidin-1-yl]acetate
CID 83998161
1-[3-[2-(1-acetylpiperidin-3-yl)ethyl]piperidin-1-yl]propan-1-one
CID 91567205
[3-(cyclopentylmethylamino)piperidin-1-yl]-thiophen-2-ylmethanone
CID 83997879
3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119260323
1-(azetidin-1-yl)-2-[[(3R)-1-[2-(cyclopentylmethoxy)acetyl]piperidin-3-yl]amino]ethanone
CID 154853211

Frequently Asked Questions

What is the IUPAC name of 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one?
The IUPAC name of 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one (CID 83997840) is 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one?
The canonical SMILES for 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one is CCC(=O)N1CCCC(NCC2CCCC2)C1.
What is the InChIKey of 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one?
The InChIKey is BPPXMMFRIDQEGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-2-14(17)16-9-5-8-13(11-16)15-10-12-6-3-4-7-12/h12-13,15H,2-11H2,1H3.
What are the key properties of 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one?
1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-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 1-[3-(cyclopentylmethylamino)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 83997840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).