2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone

C13H24N2O2 — CID 61217045

IUPAC2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone
SMILESCCOC1CCN(C(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-2-17-12-5-7-15(8-6-12)13(16)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3
InChIKeyZHNUHFNWLJUKBG-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.01
Rot. Bonds6

About 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone

2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone (PubChem CID 61217045) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone
PubChem CID61217045
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone
SMILESCCOC1CCN(C(=O)CNCC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-2-17-12-5-7-15(8-6-12)13(16)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3
InChIKeyZHNUHFNWLJUKBG-UHFFFAOYSA-N
XLogP1.01
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylmethylamino)-1-[4-(2-methylpropoxy)piperidin-1-yl]ethanone
CID 119743037
2-(cyclopropylmethylamino)-1-(3-ethoxypiperidin-1-yl)ethanone
CID 54990051
2-(cyclopropylmethylamino)-1-(4-methoxypiperidin-1-yl)ethanone;hydrochloride
CID 119697100
2-(4-aminocyclohexyl)-1-(4-ethoxypiperidin-1-yl)ethanone
CID 55117063
2-(butan-2-ylamino)-1-(4-ethoxypiperidin-1-yl)ethanone
CID 61216682
1-(4-ethoxypiperidin-1-yl)propan-1-one
CID 53016317
2-(cyclopropylmethylamino)-1-[3-(2-methylpropoxy)pyrrolidin-1-yl]ethanone;hydrochloride
CID 119821813
ethyl 4-[2-(cyclopropylmethylamino)acetyl]piperazine-1-carboxylate
CID 54916262
2-(cyclopropylmethylamino)-1-[(3S)-3-methoxypyrrolidin-1-yl]ethanone;hydrochloride
CID 119791443
2-[(4-ethylcyclohexyl)methylamino]-1-(4-methylpiperazin-1-yl)ethanone
CID 60973098
2-(cyclopropylmethylamino)-1-(4,4-diethylpiperidin-1-yl)ethanone
CID 63163435
3-(4-ethoxypiperidin-1-yl)-3-oxopropanethioamide
CID 61215632

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone?
The IUPAC name of 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone (CID 61217045) is 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone.
What is the SMILES notation for 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone?
The canonical SMILES for 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone is CCOC1CCN(C(=O)CNCC2CC2)CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone?
The InChIKey is ZHNUHFNWLJUKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-2-17-12-5-7-15(8-6-12)13(16)10-14-9-11-3-4-11/h11-12,14H,2-10H2,1H3.
What are the key properties of 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone?
2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone has a molecular weight of 240.35 g/mol, XLogP of 1.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-1-(4-ethoxypiperidin-1-yl)ethanone is sourced from PubChem (CID 61217045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).