2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide

C17H24N2O2 — CID 63682993

IUPAC2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNCC2CC3CCC2C3)cc1
InChIInChI=1S/C17H24N2O2/c1-21-16-6-4-15(5-7-16)19-17(20)11-18-10-14-9-12-2-3-13(14)8-12/h4-7,12-14,18H,2-3,8-11H2,1H3,(H,19,20)
InChIKeyDLIXNXMVBHOOSQ-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.66
Rot. Bonds6

About 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide

2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide (PubChem CID 63682993) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide
PubChem CID63682993
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CNCC2CC3CCC2C3)cc1
InChIInChI=1S/C17H24N2O2/c1-21-16-6-4-15(5-7-16)19-17(20)11-18-10-14-9-12-2-3-13(14)8-12/h4-7,12-14,18H,2-3,8-11H2,1H3,(H,19,20)
InChIKeyDLIXNXMVBHOOSQ-UHFFFAOYSA-N
XLogP2.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]-N-[4-(4-methylphenoxy)phenyl]acetamide
CID 11918943
2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-(4-methylphenyl)acetamide
CID 7733743
2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-(3,5-dimethoxyphenyl)acetamide
CID 7772878
2-[(3-hydroxycyclohexyl)methylamino]-N-(4-methoxyphenyl)acetamide
CID 106132313
N-(4-acetamidophenyl)-2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]acetamide
CID 11914325
methyl 4-[[2-(2-bicyclo[2.2.1]heptanyl)acetyl]amino]benzoate
CID 43404005
2-[(1S,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-[3-[(4-methoxyphenyl)sulfamoyl]-4-methylphenyl]acetamide
CID 129376450
2-[(1R,2S,4S)-2-bicyclo[2.2.1]heptanyl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 11915183
(1R,2R)-N-(4-methoxyphenyl)bicyclo[2.2.1]heptane-2-carboxamide
CID 100939210
methyl 2-[4-[[2-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]acetyl]amino]phenyl]acetate
CID 98750990
2-[(1R,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]acetamide
CID 21175305
2-(ethylamino)-N-(4-methoxyphenyl)acetamide
CID 2113294

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide (CID 63682993) is 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CNCC2CC3CCC2C3)cc1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide?
The InChIKey is DLIXNXMVBHOOSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-16-6-4-15(5-7-16)19-17(20)11-18-10-14-9-12-2-3-13(14)8-12/h4-7,12-14,18H,2-3,8-11H2,1H3,(H,19,20).
What are the key properties of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide?
2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide has a molecular weight of 288.39 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 63682993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).