1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide

C20H24N2O3 — CID 75504045

IUPAC1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide
SMILESCOc1ccc(Oc2ccc(CN3CCC(C(N)=O)CC3)cc2)cc1
InChIInChI=1S/C20H24N2O3/c1-24-17-6-8-19(9-7-17)25-18-4-2-15(3-5-18)14-22-12-10-16(11-13-22)20(21)23/h2-9,16H,10-14H2,1H3,(H2,21,23)
InChIKeyFMSPXTQGEKCUEL-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.18
Rot. Bonds6

About 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide

1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide (PubChem CID 75504045) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide
PubChem CID75504045
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide
SMILESCOc1ccc(Oc2ccc(CN3CCC(C(N)=O)CC3)cc2)cc1
InChIInChI=1S/C20H24N2O3/c1-24-17-6-8-19(9-7-17)25-18-4-2-15(3-5-18)14-22-12-10-16(11-13-22)20(21)23/h2-9,16H,10-14H2,1H3,(H2,21,23)
InChIKeyFMSPXTQGEKCUEL-UHFFFAOYSA-N
XLogP3.18
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4-methoxyphenyl)ethyl]piperidine-4-carboxamide
CID 9442958
1-[(4-aminophenyl)methyl]piperidine-4-carboxamide
CID 16788434
(2S)-2-hydroxy-2-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]acetamide
CID 129489219
1-[(4-bromophenyl)methyl]piperidine-4-carboxamide
CID 783332
1-[(4-phenoxyphenyl)methyl]piperidine-4-carboxylic acid
CID 3912866
[1-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]piperidin-4-yl]-pyrrolidin-1-ylmethanone
CID 25455222
sodium 4-[(4-carbamoylpiperidin-1-yl)methyl]phenolate
CID 57448397
(4-ethylpiperazin-1-yl)-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]methanone
CID 3409585
1-[[4-(1,3-benzothiazol-2-yloxy)phenyl]methyl]piperidine-4-carboxamide;dihydrochloride
CID 69147289
1-[(4-chlorophenyl)methyl]piperidine-4-carboxamide;oxalic acid
CID 45109747
1-[[4-[4-[cyclohexylmethyl(methylsulfonyl)amino]phenoxy]phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 142677090
N-(4-methoxyphenyl)-1-[(4-methylphenyl)methyl]piperidine-4-carboxamide
CID 53284727

Frequently Asked Questions

What is the IUPAC name of 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide?
The IUPAC name of 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide (CID 75504045) is 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide is COc1ccc(Oc2ccc(CN3CCC(C(N)=O)CC3)cc2)cc1.
What is the InChIKey of 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide?
The InChIKey is FMSPXTQGEKCUEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-24-17-6-8-19(9-7-17)25-18-4-2-15(3-5-18)14-22-12-10-16(11-13-22)20(21)23/h2-9,16H,10-14H2,1H3,(H2,21,23).
What are the key properties of 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide?
1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide has a molecular weight of 340.42 g/mol, XLogP of 3.18, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-(4-methoxyphenoxy)phenyl]methyl]piperidine-4-carboxamide is sourced from PubChem (CID 75504045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).