(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine

C10H17N — CID 10888093

IUPAC(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine
SMILESC=C1C(C)(C)[C@@H]2CC[C@@]1(N)C2
InChIInChI=1S/C10H17N/c1-7-9(2,3)8-4-5-10(7,11)6-8/h8H,1,4-6,11H2,2-3H3/t8-,10-/m1/s1
InChIKeyDRECVDVROUTDNN-PSASIEDQSA-N
MW151.25 g/mol
LogP2.08
Rot. Bonds

About (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine

(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine (PubChem CID 10888093) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine.

Molecular Properties

Compound Name(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine
PubChem CID10888093
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine
SMILESC=C1C(C)(C)[C@@H]2CC[C@@]1(N)C2
InChIInChI=1S/C10H17N/c1-7-9(2,3)8-4-5-10(7,11)6-8/h8H,1,4-6,11H2,2-3H3/t8-,10-/m1/s1
InChIKeyDRECVDVROUTDNN-PSASIEDQSA-N
XLogP2.08
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine?
The IUPAC name of (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine (CID 10888093) is (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine.
What is the SMILES notation for (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine?
The canonical SMILES for (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine is C=C1C(C)(C)[C@@H]2CC[C@@]1(N)C2.
What is the InChIKey of (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine?
The InChIKey is DRECVDVROUTDNN-PSASIEDQSA-N. The full InChI is InChI=1S/C10H17N/c1-7-9(2,3)8-4-5-10(7,11)6-8/h8H,1,4-6,11H2,2-3H3/t8-,10-/m1/s1.
What are the key properties of (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine?
(1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.08, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4R)-3,3-dimethyl-2-methylidenebicyclo[2.2.1]heptan-1-amine is sourced from PubChem (CID 10888093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).