cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone

C11H19NO — CID 176933785

IUPACcyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone
SMILESCC[C@@H]1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C11H19NO/c1-2-9-4-3-7-12(8-9)11(13)10-5-6-10/h9-10H,2-8H2,1H3/t9-/m1/s1
InChIKeyQNFUSHWUPSITDG-SECBINFHSA-N
MW181.28 g/mol
LogP2.05
Rot. Bonds2

About cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone

cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone (PubChem CID 176933785) has the molecular formula C11H19NO and a molecular weight of 181.28 g/mol. Its IUPAC name is cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone
PubChem CID176933785
Molecular FormulaC11H19NO
Molecular Weight181.28 g/mol
Exact Mass181.15
IUPAC Namecyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone
SMILESCC[C@@H]1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C11H19NO/c1-2-9-4-3-7-12(8-9)11(13)10-5-6-10/h9-10H,2-8H2,1H3/t9-/m1/s1
InChIKeyQNFUSHWUPSITDG-SECBINFHSA-N
XLogP2.05
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.28
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-aminocyclohexyl)-(3-ethylpiperidin-1-yl)methanone
CID 60846917
[4-(aminomethyl)cyclohexyl]-(3-ethylpiperidin-1-yl)methanone
CID 62806234
cis-(1S,3R)-3-(3-ethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 114091790
cyclopropyl-[3-[3-(hydroxymethyl)piperidine-1-carbonyl]piperidin-1-yl]methanone
CID 43589536
[3-(aminomethyl)azepan-1-yl]-cyclopropylmethanone
CID 130577977
cyclopentyl-(3-ethyl-6-methylazepan-1-yl)methanone
CID 70909624
1-[3-[2-[1-(cyclopropanecarbonyl)piperidin-3-yl]ethyl]piperidin-1-yl]-2-methylpropan-1-one
CID 68633970
[3-(methylsulfonylmethyl)piperidin-1-yl]-piperidin-4-ylmethanone;hydrochloride
CID 154910982
cyclopropyl-(4-propylazepan-1-yl)methanone
CID 49008153
(3-aminopiperidin-1-yl)-(4-methylcyclohexyl)methanone
CID 81458507
1-(3-ethylpiperidin-1-yl)-2,2,2-trifluoroethanone
CID 62490949
[3-(aminomethyl)piperidin-1-yl]-cyclooctylmethanone
CID 65019049

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone (CID 176933785) is cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone is CC[C@@H]1CCCN(C(=O)C2CC2)C1.
What is the InChIKey of cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone?
The InChIKey is QNFUSHWUPSITDG-SECBINFHSA-N. The full InChI is InChI=1S/C11H19NO/c1-2-9-4-3-7-12(8-9)11(13)10-5-6-10/h9-10H,2-8H2,1H3/t9-/m1/s1.
What are the key properties of cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone?
cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone has a molecular weight of 181.28 g/mol, XLogP of 2.05, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[(3R)-3-ethylpiperidin-1-yl]methanone is sourced from PubChem (CID 176933785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).