3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride

C14H27ClN2O — CID 119260323

IUPAC3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
SMILESCNC1CCCN(C(=O)CCC2CCCC2)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-15-13-7-4-10-16(11-13)14(17)9-8-12-5-2-3-6-12;/h12-13,15H,2-11H2,1H3;1H
InChIKeyGEIXEXLCBUUBCM-UHFFFAOYSA-N
MW274.84 g/mol
LogP2.59
Rot. Bonds4

About 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride

3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride (PubChem CID 119260323) has the molecular formula C14H27ClN2O and a molecular weight of 274.84 g/mol. Its IUPAC name is 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride.

Molecular Properties

Compound Name3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
PubChem CID119260323
Molecular FormulaC14H27ClN2O
Molecular Weight274.84 g/mol
Exact Mass274.18
IUPAC Name3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
SMILESCNC1CCCN(C(=O)CCC2CCCC2)C1.Cl
InChIInChI=1S/C14H26N2O.ClH/c1-15-13-7-4-10-16(11-13)14(17)9-8-12-5-2-3-6-12;/h12-13,15H,2-11H2,1H3;1H
InChIKeyGEIXEXLCBUUBCM-UHFFFAOYSA-N
XLogP2.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.84
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-1-[3-(methylamino)pyrrolidin-1-yl]propan-1-one
CID 81424634
3-(1-acetylpiperidin-4-yl)-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119492272
1-[3-(methylamino)piperidin-1-yl]-3-(oxan-4-yl)propan-1-one
CID 119493887
3-cyclopentyl-N-[2-[3-(methylamino)piperidin-1-yl]-2-oxoethyl]propanamide;hydrochloride
CID 119488758
2-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119260330
2-cyclobutyl-1-[3-(methylamino)piperidin-1-yl]ethanone;hydrochloride
CID 119488548
1-[3-(methylamino)piperidin-1-yl]-4-morpholin-4-ylbutane-1,4-dione;hydrochloride
CID 119493333
1-[(3S)-3-(methylamino)piperidin-1-yl]propan-1-one
CID 94475711
3,3,3-trifluoro-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride
CID 119490768
1-[3-(2-aminoethyl)piperidin-1-yl]-3-cyclopentylpropan-1-one;hydrochloride
CID 120727419
methyl 1-(3-cyclopentylpropanoyl)piperidine-3-carboxylate
CID 78919049
1-[(3R)-3-aminopiperidin-1-yl]-3-cyclohexylpropan-1-one
CID 102978602

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride?
The IUPAC name of 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride (CID 119260323) is 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride.
What is the SMILES notation for 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride?
The canonical SMILES for 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride is CNC1CCCN(C(=O)CCC2CCCC2)C1.Cl.
What is the InChIKey of 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride?
The InChIKey is GEIXEXLCBUUBCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O.ClH/c1-15-13-7-4-10-16(11-13)14(17)9-8-12-5-2-3-6-12;/h12-13,15H,2-11H2,1H3;1H.
What are the key properties of 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride?
3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride has a molecular weight of 274.84 g/mol, XLogP of 2.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-1-[3-(methylamino)piperidin-1-yl]propan-1-one;hydrochloride is sourced from PubChem (CID 119260323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).