2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide

C17H30N2O — CID 63683149

IUPAC2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide
SMILESO=C(CNCC1CC2CCC1C2)NC1CCCCCC1
InChIInChI=1S/C17H30N2O/c20-17(19-16-5-3-1-2-4-6-16)12-18-11-15-10-13-7-8-14(15)9-13/h13-16,18H,1-12H2,(H,19,20)
InChIKeyVKEDHQSNWOAAMB-UHFFFAOYSA-N
MW278.44 g/mol
LogP2.85
Rot. Bonds5

About 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide

2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide (PubChem CID 63683149) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide
PubChem CID63683149
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide
SMILESO=C(CNCC1CC2CCC1C2)NC1CCCCCC1
InChIInChI=1S/C17H30N2O/c20-17(19-16-5-3-1-2-4-6-16)12-18-11-15-10-13-7-8-14(15)9-13/h13-16,18H,1-12H2,(H,19,20)
InChIKeyVKEDHQSNWOAAMB-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(oxan-4-yl)acetamide
CID 55232432
1-[[(1R,2R,4S)-2-bicyclo[2.2.1]heptanyl]methyl]-3-cyclohexylurea
CID 26974944
N-cycloheptyl-2-[(2-methylcyclopentyl)methylamino]acetamide
CID 107417977
2-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-N-[2-(cyclopropylamino)-2-oxoethyl]acetamide
CID 18558210
N-cycloheptyl-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119674667
N-cyclohexyl-2-[(3-hydroxycyclobutyl)methylamino]acetamide
CID 66006801
2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(cyanomethyl)acetamide
CID 63682985
2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-(3-methylbutan-2-yl)acetamide
CID 63683659
N-(2-bicyclo[2.2.1]heptanylmethyl)cycloheptanamine
CID 61364545
2-(2-bicyclo[2.2.1]heptanyl)-N-(4-bromocyclohexyl)acetamide
CID 114309119
2-[1-(2-bicyclo[2.2.1]heptanyl)ethylamino]-N-cyclohexylacetamide
CID 43179826
N-cyclohexyl-2-(thiolan-2-ylmethylamino)acetamide
CID 80584523

Frequently Asked Questions

What is the IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide?
The IUPAC name of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide (CID 63683149) is 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide.
What is the SMILES notation for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide?
The canonical SMILES for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide is O=C(CNCC1CC2CCC1C2)NC1CCCCCC1.
What is the InChIKey of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide?
The InChIKey is VKEDHQSNWOAAMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c20-17(19-16-5-3-1-2-4-6-16)12-18-11-15-10-13-7-8-14(15)9-13/h13-16,18H,1-12H2,(H,19,20).
What are the key properties of 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide?
2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide has a molecular weight of 278.44 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bicyclo[2.2.1]heptanylmethylamino)-N-cycloheptylacetamide is sourced from PubChem (CID 63683149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).