2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide

C19H28FN3O3 — CID 142832460

IUPAC2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide
SMILESCc1cc(F)ccc1C1CC(OCCN2CCOCC2)CCN1C(N)=O
InChIInChI=1S/C19H28FN3O3/c1-14-12-15(20)2-3-17(14)18-13-16(4-5-23(18)19(21)24)26-11-8-22-6-9-25-10-7-22/h2-3,12,16,18H,4-11,13H2,1H3,(H2,21,24)
InChIKeyZMGCXNAOKCJVSB-UHFFFAOYSA-N
MW365.45 g/mol
LogP2.07
Rot. Bonds5

About 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide

2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide (PubChem CID 142832460) has the molecular formula C19H28FN3O3 and a molecular weight of 365.45 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide
PubChem CID142832460
Molecular FormulaC19H28FN3O3
Molecular Weight365.45 g/mol
Exact Mass365.21
IUPAC Name2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide
SMILESCc1cc(F)ccc1C1CC(OCCN2CCOCC2)CCN1C(N)=O
InChIInChI=1S/C19H28FN3O3/c1-14-12-15(20)2-3-17(14)18-13-16(4-5-23(18)19(21)24)26-11-8-22-6-9-25-10-7-22/h2-3,12,16,18H,4-11,13H2,1H3,(H2,21,24)
InChIKeyZMGCXNAOKCJVSB-UHFFFAOYSA-N
XLogP2.07
TPSA68.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.45
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide (CID 142832460) is 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide is Cc1cc(F)ccc1C1CC(OCCN2CCOCC2)CCN1C(N)=O.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide?
The InChIKey is ZMGCXNAOKCJVSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28FN3O3/c1-14-12-15(20)2-3-17(14)18-13-16(4-5-23(18)19(21)24)26-11-8-22-6-9-25-10-7-22/h2-3,12,16,18H,4-11,13H2,1H3,(H2,21,24).
What are the key properties of 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide?
2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide has a molecular weight of 365.45 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-4-(2-morpholin-4-ylethoxy)piperidine-1-carboxamide is sourced from PubChem (CID 142832460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).