2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride

C13H25ClN2O — CID 119260330

IUPAC2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
SMILESCNC1CCCN(C(=O)CC2CCCC2)C1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-14-12-7-4-8-15(10-12)13(16)9-11-5-2-3-6-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyZKSLMMREIJVWQQ-UHFFFAOYSA-N
MW260.81 g/mol
LogP2.20
Rot. Bonds3

About 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride

2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride (PubChem CID 119260330) has the molecular formula C13H25ClN2O and a molecular weight of 260.81 g/mol. Its IUPAC name is 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride.

Molecular Properties

Compound Name2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
PubChem CID119260330
Molecular FormulaC13H25ClN2O
Molecular Weight260.81 g/mol
Exact Mass260.17
IUPAC Name2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
SMILESCNC1CCCN(C(=O)CC2CCCC2)C1.Cl
InChIInChI=1S/C13H24N2O.ClH/c1-14-12-7-4-8-15(10-12)13(16)9-11-5-2-3-6-11;/h11-12,14H,2-10H2,1H3;1H
InChIKeyZKSLMMREIJVWQQ-UHFFFAOYSA-N
XLogP2.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.81
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclobutyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119488548
3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119260323
1-[3-(methylamino)piperidin-1-yl]-2-(oxolan-3-yl)ethanone;hydrochloride
CID 119489417
1-[(3S)-3-(methylamino)piperidin-1-yl]propan-1-one
CID 94475711
1-[3-(methylamino)piperidin-1-yl]-2-(3,3,5-trimethylcyclohexyl)ethanone;hydrochloride
CID 119493806
2-cyclopropyl-1-[3-(methylaminomethyl)piperidin-1-yl]ethanone;hydrochloride
CID 119398117
2-cyclobutyl-1-[4-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119560451
2-chloro-1-[(3R)-3-(methylamino)piperidin-1-yl]ethanone
CID 58168404
3-cyclopentyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]propanamide;hydrochloride
CID 119488758
3,3,3-trifluoro-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119490768
1-[(3S)-3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 172646124
2-cyclopentyl-1-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]ethanone
CID 63241290

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride?
The IUPAC name of 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride (CID 119260330) is 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride.
What is the SMILES notation for 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride?
The canonical SMILES for 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride is CNC1CCCN(C(=O)CC2CCCC2)C1.Cl.
What is the InChIKey of 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride?
The InChIKey is ZKSLMMREIJVWQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O.ClH/c1-14-12-7-4-8-15(10-12)13(16)9-11-5-2-3-6-11;/h11-12,14H,2-10H2,1H3;1H.
What are the key properties of 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride?
2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride has a molecular weight of 260.81 g/mol, XLogP of 2.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride is sourced from PubChem (CID 119260330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).