N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide

C16H21FN2O2 — CID 154814789

IUPACN-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide
SMILESO=C(COc1ccc(C2CCNCC2)c(F)c1)NC1CC1
InChIInChI=1S/C16H21FN2O2/c17-15-9-13(21-10-16(20)19-12-1-2-12)3-4-14(15)11-5-7-18-8-6-11/h3-4,9,11-12,18H,1-2,5-8,10H2,(H,19,20)
InChIKeyMMLRMGWCCPXZMK-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.95
Rot. Bonds5

About N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide

N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide (PubChem CID 154814789) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide
PubChem CID154814789
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC NameN-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide
SMILESO=C(COc1ccc(C2CCNCC2)c(F)c1)NC1CC1
InChIInChI=1S/C16H21FN2O2/c17-15-9-13(21-10-16(20)19-12-1-2-12)3-4-14(15)11-5-7-18-8-6-11/h3-4,9,11-12,18H,1-2,5-8,10H2,(H,19,20)
InChIKeyMMLRMGWCCPXZMK-UHFFFAOYSA-N
XLogP1.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide;hydrochloride
CID 154814788
N-cyclohexyl-2-(3,4-difluorophenoxy)acetamide
CID 78767908
N-piperidin-4-yl-2-[3-(trifluoromethyl)phenoxy]acetamide
CID 119386965
4-[2-fluoro-4-(2,2,2-trifluoroethoxy)phenyl]piperidine;hydrochloride
CID 134691211
2-(3,4-dichlorophenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119386912
2-(3-methylphenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119388822
2-(3,4-dimethylphenoxy)-N-piperidin-4-ylacetamide;hydrochloride
CID 119386968
2-(4-iodophenoxy)-N-piperidin-4-ylacetamide
CID 119389070
2-(4-bromophenoxy)-N-piperidin-4-ylacetamide
CID 119386339
2-(2-fluorophenoxy)-N-piperidin-4-ylacetamide
CID 110488066
2-(4-chlorophenoxy)-N-[4-[[2-(3,5-difluorophenoxy)acetyl]amino]cyclohexyl]acetamide
CID 121260487
2-(4-bromo-2-fluorophenoxy)-N-piperidin-4-ylacetamide
CID 119388777

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide?
The IUPAC name of N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide (CID 154814789) is N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide?
The canonical SMILES for N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide is O=C(COc1ccc(C2CCNCC2)c(F)c1)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide?
The InChIKey is MMLRMGWCCPXZMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c17-15-9-13(21-10-16(20)19-12-1-2-12)3-4-14(15)11-5-7-18-8-6-11/h3-4,9,11-12,18H,1-2,5-8,10H2,(H,19,20).
What are the key properties of N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide?
N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide has a molecular weight of 292.35 g/mol, XLogP of 1.95, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(3-fluoro-4-piperidin-4-ylphenoxy)acetamide is sourced from PubChem (CID 154814789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).