methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate

C16H22N2O5 — CID 70764459

IUPACmethyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
SMILESCOC(=O)NCC(=O)N1CCC(Oc2ccccc2OC)CC1
InChIInChI=1S/C16H22N2O5/c1-21-13-5-3-4-6-14(13)23-12-7-9-18(10-8-12)15(19)11-17-16(20)22-2/h3-6,12H,7-11H2,1-2H3,(H,17,20)
InChIKeyLWXDVUPKSQFIAT-UHFFFAOYSA-N
MW322.36 g/mol
LogP1.42
Rot. Bonds5

About methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate

methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate (PubChem CID 70764459) has the molecular formula C16H22N2O5 and a molecular weight of 322.36 g/mol. Its IUPAC name is methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
PubChem CID70764459
Molecular FormulaC16H22N2O5
Molecular Weight322.36 g/mol
Exact Mass322.15
IUPAC Namemethyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
SMILESCOC(=O)NCC(=O)N1CCC(Oc2ccccc2OC)CC1
InChIInChI=1S/C16H22N2O5/c1-21-13-5-3-4-6-14(13)23-12-7-9-18(10-8-12)15(19)11-17-16(20)22-2/h3-6,12H,7-11H2,1-2H3,(H,17,20)
InChIKeyLWXDVUPKSQFIAT-UHFFFAOYSA-N
XLogP1.42
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate with MolForge

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Related Compounds

2-hydroxy-1-[4-(2-methoxyphenoxy)piperidin-1-yl]ethanone
CID 70754980
2-(2-methoxyethoxy)-1-[4-(2-methoxyphenoxy)piperidin-1-yl]ethanone
CID 70748201
methyl N-[2-[4-(3-methylphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
CID 70757574
methyl N-[2-[4-(3-fluorophenoxy)piperidin-1-yl]-2-oxoethyl]carbamate
CID 70728293
4-[4-(2-methoxyphenoxy)piperidin-1-yl]-4-oxobutane-1-sulfonamide
CID 70735264
1-(4-aminopiperidin-1-yl)-2-(2-methoxyanilino)ethanone
CID 119373605
(4S)-4-[4-(2-methoxyphenoxy)piperidine-1-carbonyl]-1-methylimidazolidin-2-one
CID 95872118
2-methoxy-N-(2-oxo-2-piperidin-1-ylethyl)benzamide
CID 36866031
methyl N-[1-(2-benzamidoacetyl)piperidin-4-yl]carbamate
CID 110821590
3-(4,5-dimethyl-1H-pyrazol-3-yl)-1-[4-(2-methoxyphenoxy)piperidin-1-yl]propan-1-one
CID 70713988
1-[4-(2-methoxyphenoxy)piperidin-1-yl]-3-(4-methyl-1,3-thiazol-5-yl)propan-1-one
CID 70786598
N-[2-[4-(2,5-dimethylphenoxy)piperidin-1-yl]-2-oxoethyl]benzamide
CID 60574366

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate?
The IUPAC name of methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate (CID 70764459) is methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate.
What is the SMILES notation for methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate?
The canonical SMILES for methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate is COC(=O)NCC(=O)N1CCC(Oc2ccccc2OC)CC1.
What is the InChIKey of methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate?
The InChIKey is LWXDVUPKSQFIAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O5/c1-21-13-5-3-4-6-14(13)23-12-7-9-18(10-8-12)15(19)11-17-16(20)22-2/h3-6,12H,7-11H2,1-2H3,(H,17,20).
What are the key properties of methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate?
methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate has a molecular weight of 322.36 g/mol, XLogP of 1.42, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-[4-(2-methoxyphenoxy)piperidin-1-yl]-2-oxoethyl]carbamate is sourced from PubChem (CID 70764459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).