2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide

C16H24N2O2 — CID 8583685

IUPAC2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCCCCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-20-15-9-7-8-14(12-15)17-16(19)13-18-10-5-3-2-4-6-11-18/h7-9,12H,2-6,10-11,13H2,1H3,(H,17,19)
InChIKeyDXAKLOIHDBIBOS-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.90
Rot. Bonds4

About 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide

2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide (PubChem CID 8583685) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
PubChem CID8583685
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CN2CCCCCCC2)c1
InChIInChI=1S/C16H24N2O2/c1-20-15-9-7-8-14(12-15)17-16(19)13-18-10-5-3-2-4-6-11-18/h7-9,12H,2-6,10-11,13H2,1H3,(H,17,19)
InChIKeyDXAKLOIHDBIBOS-UHFFFAOYSA-N
XLogP2.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(azepan-1-yl)-N-[3-(2-methoxyethoxy)phenyl]acetamide
CID 54814501
2-[4-(cyclohexylmethyl)-1,4-diazepan-1-yl]-N-(3-methoxyphenyl)acetamide
CID 55864033
2-(azepan-1-yl)-N-(3-propan-2-yloxyphenyl)acetamide
CID 54814466
N-(3-methoxyphenyl)-2-(4-methylpiperazin-1-yl)acetamide;hydrochloride
CID 2958479
2-(3-methoxyphenyl)-N-[4-[(2-piperidin-1-ylacetyl)amino]phenyl]acetamide
CID 131909721
N-(4-fluorophenyl)-2-[4-[2-(3-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 7336695
2-[3-(hydroxymethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide
CID 60642548
2-(azocan-1-yl)-N-(3-methylphenyl)acetamide
CID 2655272
N-[3-[[2-(azepan-1-yl)acetyl]amino]phenyl]propanamide
CID 54814595
N-benzyl-2-[4-[2-(3-methoxyanilino)-2-oxoethyl]piperazin-1-yl]acetamide
CID 29487815
2-[3-(aminomethyl)piperidin-1-yl]-N-(3-methoxyphenyl)acetamide;hydrochloride
CID 119915580
N-(3-methoxyphenyl)-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide
CID 9257418

Frequently Asked Questions

What is the IUPAC name of 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide (CID 8583685) is 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CN2CCCCCCC2)c1.
What is the InChIKey of 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide?
The InChIKey is DXAKLOIHDBIBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-20-15-9-7-8-14(12-15)17-16(19)13-18-10-5-3-2-4-6-11-18/h7-9,12H,2-6,10-11,13H2,1H3,(H,17,19).
What are the key properties of 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide?
2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide has a molecular weight of 276.38 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(azocan-1-yl)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 8583685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).