N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide

C16H24N2O3 — CID 81368842

IUPACN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide
SMILESCOc1ccc([C@H](C)NC(=O)COC2CCNCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-12(13-3-5-14(20-2)6-4-13)18-16(19)11-21-15-7-9-17-10-8-15/h3-6,12,15,17H,7-11H2,1-2H3,(H,18,19)/t12-/m0/s1
InChIKeyBTAJXSVGGBQMJG-LBPRGKRZSA-N
MW292.38 g/mol
LogP1.64
Rot. Bonds6

About N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide

N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide (PubChem CID 81368842) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide
PubChem CID81368842
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC NameN-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide
SMILESCOc1ccc([C@H](C)NC(=O)COC2CCNCC2)cc1
InChIInChI=1S/C16H24N2O3/c1-12(13-3-5-14(20-2)6-4-13)18-16(19)11-21-15-7-9-17-10-8-15/h3-6,12,15,17H,7-11H2,1-2H3,(H,18,19)/t12-/m0/s1
InChIKeyBTAJXSVGGBQMJG-LBPRGKRZSA-N
XLogP1.64
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(4-fluorophenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 63876747
N-[(1R)-1-(4-chlorophenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 81355328
N-[1-(3-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 63876727
N-[1-(4-methoxyphenyl)ethyl]-2-pyrrolidin-2-ylacetamide
CID 66195074
N-[1-(2-fluorophenyl)ethyl]-2-piperidin-4-yloxyacetamide
CID 63876556
2-(azetidin-3-yl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
CID 66196031
N-(3-methylbutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 61489309
2-(4-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 94843836
2-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364080
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81370298
2-[4-[(2S)-2-[(2-piperidin-4-yloxyacetyl)amino]propanoyl]phenoxy]acetic acid
CID 67570091
N-(4-methoxybutan-2-yl)-2-piperidin-4-yloxyacetamide
CID 64604853

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide (CID 81368842) is N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide is COc1ccc([C@H](C)NC(=O)COC2CCNCC2)cc1.
What is the InChIKey of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide?
The InChIKey is BTAJXSVGGBQMJG-LBPRGKRZSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-12(13-3-5-14(20-2)6-4-13)18-16(19)11-21-15-7-9-17-10-8-15/h3-6,12,15,17H,7-11H2,1-2H3,(H,18,19)/t12-/m0/s1.
What are the key properties of N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide?
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide has a molecular weight of 292.38 g/mol, XLogP of 1.64, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 81368842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).