N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide

C12H19NO — CID 15226169

IUPACN-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide
SMILESC=C1C2CCC(NC(C)=O)(C2)C1(C)C
InChIInChI=1S/C12H19NO/c1-8-10-5-6-12(7-10,11(8,3)4)13-9(2)14/h10H,1,5-7H2,2-4H3,(H,13,14)
InChIKeyRZYOTQJONAWEEQ-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.26
Rot. Bonds1

About N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide

N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide (PubChem CID 15226169) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide.

Molecular Properties

Compound NameN-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide
PubChem CID15226169
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide
SMILESC=C1C2CCC(NC(C)=O)(C2)C1(C)C
InChIInChI=1S/C12H19NO/c1-8-10-5-6-12(7-10,11(8,3)4)13-9(2)14/h10H,1,5-7H2,2-4H3,(H,13,14)
InChIKeyRZYOTQJONAWEEQ-UHFFFAOYSA-N
XLogP2.26
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl) 2-methylprop-2-enoate
CID 140650831
(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)methyl acetate
CID 155673445
2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptan-1-amine
CID 21387451
1-[(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)sulfonyl]-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane
CID 175728927
1-[(1S,4S)-2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl]-3-phenylpropan-1-one
CID 162827825
N-[(1S,4S)-3,3-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]acetamide
CID 100974416
1-isothiocyanato-2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane
CID 139815055
(R,2R,3R,6S,9R,10R)-hydroxy-2,9,10-trimethyl-7-methylidene-octahydro-1H-2,4a-methanonapthalen-1-one
CID 101239015
(S,2S,9S,10S)-hydroxy-2,9,10-trimethyl-7-methylidene-octahydro-1H-2,4a-methanonapthalen-1-one
CID 139583374
N-(1-methyl-4-propan-2-ylcyclohexyl)acetamide
CID 146393556
N-(1-cyclopropylcyclopropyl)acetamide
CID 131085975
N-(3-methyl-8-azabicyclo[3.2.1]octan-3-yl)acetamide
CID 59134556

Frequently Asked Questions

What is the IUPAC name of N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide?
The IUPAC name of N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide (CID 15226169) is N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide.
What is the SMILES notation for N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide?
The canonical SMILES for N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide is C=C1C2CCC(NC(C)=O)(C2)C1(C)C.
What is the InChIKey of N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide?
The InChIKey is RZYOTQJONAWEEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-8-10-5-6-12(7-10,11(8,3)4)13-9(2)14/h10H,1,5-7H2,2-4H3,(H,13,14).
What are the key properties of N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide?
N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide has a molecular weight of 193.29 g/mol, XLogP of 2.26, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-dimethyl-3-methylidene-1-bicyclo[2.2.1]heptanyl)acetamide is sourced from PubChem (CID 15226169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).