(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone

C14H26N2O — CID 171093987

IUPAC(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone
SMILESCCC1CCN(C(=O)C2CN(C(C)C)C2)CC1
InChIInChI=1S/C14H26N2O/c1-4-12-5-7-15(8-6-12)14(17)13-9-16(10-13)11(2)3/h11-13H,4-10H2,1-3H3
InChIKeyFNAAGLSYXVDISS-UHFFFAOYSA-N
MW238.37 g/mol
LogP1.98
Rot. Bonds3

About (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone

(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone (PubChem CID 171093987) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone.

Molecular Properties

Compound Name(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone
PubChem CID171093987
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone
SMILESCCC1CCN(C(=O)C2CN(C(C)C)C2)CC1
InChIInChI=1S/C14H26N2O/c1-4-12-5-7-15(8-6-12)14(17)13-9-16(10-13)11(2)3/h11-13H,4-10H2,1-3H3
InChIKeyFNAAGLSYXVDISS-UHFFFAOYSA-N
XLogP1.98
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(4-ethylcyclohexyl)-[4-[2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperidin-1-yl]methanone
CID 167480439
cis-(1S,3R)-3-(4-ethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 114091996
ethane;1-(4-ethylpiperidin-1-yl)-2-(1-propan-2-ylpiperidin-4-yl)ethanone
CID 176984732
[4-(aminomethyl)cyclohexyl]-(4-ethylpiperidin-1-yl)methanone
CID 62807473
(4-ethylpiperazin-1-yl)-[(3S)-1-propan-2-ylpyrrolidin-3-yl]methanone
CID 170184818
(3-amino-4-methylcyclohexyl)-(4-ethylpiperidin-1-yl)methanone
CID 62780914
(9-amino-3-bicyclo[3.3.1]nonanyl)-(4-ethylpiperidin-1-yl)methanone
CID 120986818
1-(3-ethylpyrrolidin-1-yl)-2-(4-propan-2-ylpiperazin-1-yl)ethanone
CID 176984404
(3-aminocyclopentyl)-(4-ethylazepan-1-yl)methanone;hydrochloride
CID 119794884
(4-ethylpiperidin-1-yl)-[(3S)-piperidin-3-yl]methanone
CID 81129798
cyclopropyl-[4-(methylsulfonylmethyl)piperidin-1-yl]methanone
CID 110736017
(4-butan-2-ylpiperazin-1-yl)-(4-ethylpiperidin-1-yl)methanone
CID 176984609

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone?
The IUPAC name of (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone (CID 171093987) is (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone.
What is the SMILES notation for (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone?
The canonical SMILES for (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone is CCC1CCN(C(=O)C2CN(C(C)C)C2)CC1.
What is the InChIKey of (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone?
The InChIKey is FNAAGLSYXVDISS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-4-12-5-7-15(8-6-12)14(17)13-9-16(10-13)11(2)3/h11-13H,4-10H2,1-3H3.
What are the key properties of (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone?
(4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone has a molecular weight of 238.37 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperidin-1-yl)-(1-propan-2-ylazetidin-3-yl)methanone is sourced from PubChem (CID 171093987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).