N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide

C19H21FN2O2 — CID 67036908

IUPACN-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2cccc(Oc3ccc(F)cc3)c2)CCNCC1
InChIInChI=1S/C19H21FN2O2/c1-19(9-11-21-12-10-19)18(23)22-15-3-2-4-17(13-15)24-16-7-5-14(20)6-8-16/h2-8,13,21H,9-12H2,1H3,(H,22,23)
InChIKeyUCSFYOWCMBNDBX-UHFFFAOYSA-N
MW328.39 g/mol
LogP3.95
Rot. Bonds4

About N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide

N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide (PubChem CID 67036908) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide
PubChem CID67036908
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide
SMILESCC1(C(=O)Nc2cccc(Oc3ccc(F)cc3)c2)CCNCC1
InChIInChI=1S/C19H21FN2O2/c1-19(9-11-21-12-10-19)18(23)22-15-3-2-4-17(13-15)24-16-7-5-14(20)6-8-16/h2-8,13,21H,9-12H2,1H3,(H,22,23)
InChIKeyUCSFYOWCMBNDBX-UHFFFAOYSA-N
XLogP3.95
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-N-[3-(propanoylamino)phenyl]piperidine-4-carboxamide
CID 63122404
3-methyl-N-[3-(2-methylpropoxy)phenyl]pyrrolidine-3-carboxamide
CID 63139773
N-(2,6-difluorophenyl)-4-methylpiperidine-4-carboxamide
CID 55177937
4-methyl-N-(3,4,5-trifluorophenyl)piperidine-4-carboxamide
CID 55177366
4-methyl-N-(3-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 63122188
4-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]piperidine-4-carboxamide;hydrochloride
CID 120617162
N-(4-fluoro-2-methylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121495
N-[3-[(3-fluorophenyl)methoxy]phenyl]-4-(methoxymethyl)piperidine-4-carboxamide
CID 120624422
1-(aminomethyl)-N-(3-phenoxyphenyl)cyclopropane-1-carboxamide
CID 80588714
4-methyl-N-(4-methylphenyl)piperidine-4-carboxamide
CID 63121506
N-(4-carbamoylphenyl)-4-methylpiperidine-4-carboxamide
CID 63121565
4-methoxy-N-(3-pyridin-2-yloxyphenyl)piperidine-4-carboxamide
CID 119884858

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide?
The IUPAC name of N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide (CID 67036908) is N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide.
What is the SMILES notation for N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide?
The canonical SMILES for N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide is CC1(C(=O)Nc2cccc(Oc3ccc(F)cc3)c2)CCNCC1.
What is the InChIKey of N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide?
The InChIKey is UCSFYOWCMBNDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-19(9-11-21-12-10-19)18(23)22-15-3-2-4-17(13-15)24-16-7-5-14(20)6-8-16/h2-8,13,21H,9-12H2,1H3,(H,22,23).
What are the key properties of N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide?
N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide has a molecular weight of 328.39 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-fluorophenoxy)phenyl]-4-methylpiperidine-4-carboxamide is sourced from PubChem (CID 67036908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).