N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide

C14H19BrN2O3 — CID 82867239

IUPACN-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide
SMILESCOc1cc(Br)cc(NC(=O)COC2CCNCC2)c1
InChIInChI=1S/C14H19BrN2O3/c1-19-13-7-10(15)6-11(8-13)17-14(18)9-20-12-2-4-16-5-3-12/h6-8,12,16H,2-5,9H2,1H3,(H,17,18)
InChIKeyJRUJDLFGNWQRHI-UHFFFAOYSA-N
MW343.22 g/mol
LogP2.16
Rot. Bonds5

About N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide

N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide (PubChem CID 82867239) has the molecular formula C14H19BrN2O3 and a molecular weight of 343.22 g/mol. Its IUPAC name is N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide
PubChem CID82867239
Molecular FormulaC14H19BrN2O3
Molecular Weight343.22 g/mol
Exact Mass342.06
IUPAC NameN-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide
SMILESCOc1cc(Br)cc(NC(=O)COC2CCNCC2)c1
InChIInChI=1S/C14H19BrN2O3/c1-19-13-7-10(15)6-11(8-13)17-14(18)9-20-12-2-4-16-5-3-12/h6-8,12,16H,2-5,9H2,1H3,(H,17,18)
InChIKeyJRUJDLFGNWQRHI-UHFFFAOYSA-N
XLogP2.16
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.22
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxyphenyl)-2-pyrrolidin-3-yloxyacetamide
CID 62327564
N-(4-fluorophenyl)-2-piperidin-4-yloxyacetamide
CID 39062765
N-(3,5-dimethoxyphenyl)-2-piperidin-4-ylacetamide
CID 24703765
N-(4-fluoro-3-methoxyphenyl)-2-piperidin-4-yloxyacetamide
CID 114839705
N-(3,5-dimethoxyphenyl)-3-piperidin-4-ylpropanamide
CID 62210135
2-piperidin-4-yloxy-N-(4-propoxyphenyl)acetamide
CID 63876932
N-(3-iodo-4-methylphenyl)-2-piperidin-4-yloxyacetamide
CID 63876197
N-(3-methoxyphenyl)-3-piperidin-4-yloxypropanamide
CID 63875432
2-piperidin-4-yloxy-N-(2,4,6-trimethylphenyl)acetamide
CID 39062816
N-(2,6-dibromophenyl)-2-piperidin-4-yloxyacetamide
CID 107599717
2-piperidin-4-yloxy-N-(4-propylphenyl)acetamide
CID 63877579
(2S)-N-(3-bromo-5-methoxyphenyl)pyrrolidine-2-carboxamide
CID 82867240

Frequently Asked Questions

What is the IUPAC name of N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide (CID 82867239) is N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide is COc1cc(Br)cc(NC(=O)COC2CCNCC2)c1.
What is the InChIKey of N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide?
The InChIKey is JRUJDLFGNWQRHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19BrN2O3/c1-19-13-7-10(15)6-11(8-13)17-14(18)9-20-12-2-4-16-5-3-12/h6-8,12,16H,2-5,9H2,1H3,(H,17,18).
What are the key properties of N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide?
N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide has a molecular weight of 343.22 g/mol, XLogP of 2.16, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromo-5-methoxyphenyl)-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 82867239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).