1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone

C18H32N2O2 — CID 84596160

IUPAC1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC2CCCCC2OC2CCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-14(21)20-12-10-15(11-13-20)19-17-8-4-5-9-18(17)22-16-6-2-3-7-16/h15-19H,2-13H2,1H3
InChIKeyFZHVVTPHRXFPCV-UHFFFAOYSA-N
MW308.47 g/mol
LogP2.86
Rot. Bonds4

About 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone

1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone (PubChem CID 84596160) has the molecular formula C18H32N2O2 and a molecular weight of 308.47 g/mol. Its IUPAC name is 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone.

Molecular Properties

Compound Name1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone
PubChem CID84596160
Molecular FormulaC18H32N2O2
Molecular Weight308.47 g/mol
Exact Mass308.25
IUPAC Name1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone
SMILESCC(=O)N1CCC(NC2CCCCC2OC2CCCC2)CC1
InChIInChI=1S/C18H32N2O2/c1-14(21)20-12-10-15(11-13-20)19-17-8-4-5-9-18(17)22-16-6-2-3-7-16/h15-19H,2-13H2,1H3
InChIKeyFZHVVTPHRXFPCV-UHFFFAOYSA-N
XLogP2.86
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.47
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(cyclopentylamino)piperidin-1-yl]ethanone
CID 43222863
1-[4-[(2-methylsulfonylcyclopentyl)amino]piperidin-1-yl]ethanone
CID 65044493
cyclopropyl-[4-[(2-methoxycyclohexyl)amino]piperidin-1-yl]methanone
CID 43791479
1-[4-[[2-(trifluoromethyl)cyclohexyl]amino]piperidin-1-yl]ethanone
CID 43434521
2-methoxy-1-[4-[(2-methoxycyclohexyl)amino]piperidin-1-yl]ethanone
CID 43791436
1-[4-[(2,3-dimethylcyclopentyl)amino]piperidin-1-yl]ethanone
CID 64907781
1-[4-(3-cyclohexyloxypropylamino)piperidin-1-yl]ethanone
CID 43225558
4-cyclopentyloxy-N-methylpiperidine-1-carboxamide
CID 71687221
1-[4-[(1-propan-2-ylpiperidin-4-yl)amino]piperidin-1-yl]ethanone
CID 43223565
4-[(2-hydroxycyclohexyl)amino]piperidine-1-carboxamide
CID 55064221
(2R)-N-(1-acetylpiperidin-4-yl)-2-cyclopentyloxy-2-phenylacetamide
CID 95304150
N-(1-acetylpiperidin-4-yl)acetamide
CID 23402928

Frequently Asked Questions

What is the IUPAC name of 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone?
The IUPAC name of 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone (CID 84596160) is 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone.
What is the SMILES notation for 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone?
The canonical SMILES for 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone is CC(=O)N1CCC(NC2CCCCC2OC2CCCC2)CC1.
What is the InChIKey of 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone?
The InChIKey is FZHVVTPHRXFPCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O2/c1-14(21)20-12-10-15(11-13-20)19-17-8-4-5-9-18(17)22-16-6-2-3-7-16/h15-19H,2-13H2,1H3.
What are the key properties of 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone?
1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone has a molecular weight of 308.47 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(2-cyclopentyloxycyclohexyl)amino]piperidin-1-yl]ethanone is sourced from PubChem (CID 84596160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).