4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide

C18H24N2O3 — CID 42153100

IUPAC4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C18H24N2O3/c1-2-19-17(21)13-5-7-15(8-6-13)23-16-9-11-20(12-10-16)18(22)14-3-4-14/h5-8,14,16H,2-4,9-12H2,1H3,(H,19,21)
InChIKeyMWZVINQKYOYWAB-UHFFFAOYSA-N
MW316.40 g/mol
LogP2.22
Rot. Bonds5

About 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide

4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide (PubChem CID 42153100) has the molecular formula C18H24N2O3 and a molecular weight of 316.40 g/mol. Its IUPAC name is 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide.

Molecular Properties

Compound Name4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide
PubChem CID42153100
Molecular FormulaC18H24N2O3
Molecular Weight316.40 g/mol
Exact Mass316.18
IUPAC Name4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1
InChIInChI=1S/C18H24N2O3/c1-2-19-17(21)13-5-7-15(8-6-13)23-16-9-11-20(12-10-16)18(22)14-3-4-14/h5-8,14,16H,2-4,9-12H2,1H3,(H,19,21)
InChIKeyMWZVINQKYOYWAB-UHFFFAOYSA-N
XLogP2.22
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.40
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 72844969
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[2-[(2R)-1-methylpyrrolidin-2-yl]ethyl]benzamide
CID 42241527
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[(2R)-2-phenylpropyl]benzamide
CID 42508142
N-[(2-chlorophenyl)methyl]-4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzamide
CID 30920617
ethyl 4-[[4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzoyl]amino]piperidine-1-carboxylate
CID 25378335
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-(3-phenylpropyl)benzamide
CID 25395722
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]benzamide
CID 72887706
cyclopropyl-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396800
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 30921211
N-[(2-amino-3-pyridinyl)methyl]-4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxybenzamide
CID 72903010
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-[(2R)-6-hydroxy-6-methylheptan-2-yl]benzamide
CID 42305765
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-(1-thiophen-2-ylethyl)benzamide
CID 45216516

Frequently Asked Questions

What is the IUPAC name of 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide?
The IUPAC name of 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide (CID 42153100) is 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide.
What is the SMILES notation for 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide?
The canonical SMILES for 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide is CCNC(=O)c1ccc(OC2CCN(C(=O)C3CC3)CC2)cc1.
What is the InChIKey of 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide?
The InChIKey is MWZVINQKYOYWAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3/c1-2-19-17(21)13-5-7-15(8-6-13)23-16-9-11-20(12-10-16)18(22)14-3-4-14/h5-8,14,16H,2-4,9-12H2,1H3,(H,19,21).
What are the key properties of 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide?
4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide has a molecular weight of 316.40 g/mol, XLogP of 2.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(cyclopropanecarbonyl)piperidin-4-yl]oxy-N-ethylbenzamide is sourced from PubChem (CID 42153100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).