2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide

C16H31N3O — CID 86868172

IUPAC2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(NC(=O)CN(C)CC2CCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-3-19-10-8-15(9-11-19)17-16(20)13-18(2)12-14-6-4-5-7-14/h14-15H,3-13H2,1-2H3,(H,17,20)
InChIKeyUQRJFZLTCRLONZ-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.71
Rot. Bonds6

About 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide

2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide (PubChem CID 86868172) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound Name2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide
PubChem CID86868172
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC Name2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide
SMILESCCN1CCC(NC(=O)CN(C)CC2CCCC2)CC1
InChIInChI=1S/C16H31N3O/c1-3-19-10-8-15(9-11-19)17-16(20)13-18(2)12-14-6-4-5-7-14/h14-15H,3-13H2,1-2H3,(H,17,20)
InChIKeyUQRJFZLTCRLONZ-UHFFFAOYSA-N
XLogP1.71
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethylpiperidin-4-yl)-2-[methyl(oxan-2-ylmethyl)amino]acetamide
CID 86826056
N-cycloheptyl-2-[[1-[(2R)-2-hydroxypropyl]piperidin-4-yl]methyl-methylamino]acetamide
CID 95346098
2-[[2-(tert-butylamino)-2-oxoethyl]-methylamino]-N-(1-ethylpiperidin-4-yl)acetamide
CID 86908543
N-cyclopentyl-2-[methyl(piperidin-4-ylmethyl)amino]acetamide
CID 79717424
N-cyclohexyl-2-[methyl(piperidin-3-ylmethyl)amino]acetamide
CID 106636311
2-[ethyl(2-hydroxyethyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide
CID 110881299
2-(cyclopropylmethylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 54917428
2-[[1-(2-hydroxyethyl)piperidin-4-yl]methyl-methylamino]-N-[(1R,2R)-2-methylcyclohexyl]acetamide
CID 95345385
2-[[2-(4-bromo-2-methylanilino)-2-oxoethyl]-methylamino]-N-(1-ethylpiperidin-4-yl)acetamide
CID 8790519
N-(1-ethylpiperidin-4-yl)-4-hydroxybutanamide
CID 79192481
(1-ethylpiperidin-4-yl)carbamic acid;hydrochloride
CID 68989076
5-[(1-ethylpiperidin-4-yl)amino]-3-methyl-5-oxopentanoic acid
CID 62963713

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide?
The IUPAC name of 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide (CID 86868172) is 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide.
What is the SMILES notation for 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide?
The canonical SMILES for 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide is CCN1CCC(NC(=O)CN(C)CC2CCCC2)CC1.
What is the InChIKey of 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide?
The InChIKey is UQRJFZLTCRLONZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-3-19-10-8-15(9-11-19)17-16(20)13-18(2)12-14-6-4-5-7-14/h14-15H,3-13H2,1-2H3,(H,17,20).
What are the key properties of 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide?
2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide has a molecular weight of 281.44 g/mol, XLogP of 1.71, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentylmethyl(methyl)amino]-N-(1-ethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 86868172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).