N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide

C13H19NO — CID 43700056

IUPACN-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide
SMILESC=CC(=O)NC1CC2CC1C1CCCC21
InChIInChI=1S/C13H19NO/c1-2-13(15)14-12-7-8-6-11(12)10-5-3-4-9(8)10/h2,8-12H,1,3-7H2,(H,14,15)
InChIKeyUQIQMIBAXNOGFH-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.11
Rot. Bonds2

About N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide

N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide (PubChem CID 43700056) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide.

Molecular Properties

Compound NameN-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide
PubChem CID43700056
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC NameN-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide
SMILESC=CC(=O)NC1CC2CC1C1CCCC21
InChIInChI=1S/C13H19NO/c1-2-13(15)14-12-7-8-6-11(12)10-5-3-4-9(8)10/h2,8-12H,1,3-7H2,(H,14,15)
InChIKeyUQIQMIBAXNOGFH-UHFFFAOYSA-N
XLogP2.11
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

2-Propenamide, N-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)-
CID 3824523
Acetamide, N-(octahydro-4,7-methano-1H-inden-5-yl)-, (3a-alpha,4-beta,5-alpha,7-beta,7a-alpha)-
CID 3056050
3-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)but-2-enamide
CID 42958251
N-(Octahydro-4,7-methano-1H-inden-5-yl)acetamide
CID 14589595
N-[(1R,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]prop-2-enamide
CID 950914
N-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]prop-2-enamide
CID 950915
2-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide
CID 20727704
N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide
CID 20727712
N-(9-tricyclo[6.2.1.02,7]undecanyl)prop-2-enamide
CID 20727713
N-methyl-N-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)prop-2-enamide
CID 20727716
2-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide
CID 58205339
N-methyl-N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide
CID 58205345

Frequently Asked Questions

What is the IUPAC name of N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide?
The IUPAC name of N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide (CID 43700056) is N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide.
What is the SMILES notation for N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide?
The canonical SMILES for N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide is C=CC(=O)NC1CC2CC1C1CCCC21.
What is the InChIKey of N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide?
The InChIKey is UQIQMIBAXNOGFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-13(15)14-12-7-8-6-11(12)10-5-3-4-9(8)10/h2,8-12H,1,3-7H2,(H,14,15).
What are the key properties of N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide?
N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide has a molecular weight of 205.30 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(8-tricyclo[5.2.1.02,6]decanyl)prop-2-enamide is sourced from PubChem (CID 43700056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).