N,N-dimethylbicyclo[2.2.1]heptan-7-amine

C9H17N — CID 58923790

IUPACN,N-dimethylbicyclo[2.2.1]heptan-7-amine
SMILESCN(C)C1C2CCC1CC2
InChIInChI=1S/C9H17N/c1-10(2)9-7-3-4-8(9)6-5-7/h7-9H,3-6H2,1-2H3
InChIKeyBDBXMEUWEKDUFP-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.74
Rot. Bonds1

About N,N-dimethylbicyclo[2.2.1]heptan-7-amine

N,N-dimethylbicyclo[2.2.1]heptan-7-amine (PubChem CID 58923790) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is N,N-dimethylbicyclo[2.2.1]heptan-7-amine.

Molecular Properties

Compound NameN,N-dimethylbicyclo[2.2.1]heptan-7-amine
PubChem CID58923790
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC NameN,N-dimethylbicyclo[2.2.1]heptan-7-amine
SMILESCN(C)C1C2CCC1CC2
InChIInChI=1S/C9H17N/c1-10(2)9-7-3-4-8(9)6-5-7/h7-9H,3-6H2,1-2H3
InChIKeyBDBXMEUWEKDUFP-UHFFFAOYSA-N
XLogP1.74
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethylbicyclo[2.2.1]heptan-7-amine?
The IUPAC name of N,N-dimethylbicyclo[2.2.1]heptan-7-amine (CID 58923790) is N,N-dimethylbicyclo[2.2.1]heptan-7-amine.
What is the SMILES notation for N,N-dimethylbicyclo[2.2.1]heptan-7-amine?
The canonical SMILES for N,N-dimethylbicyclo[2.2.1]heptan-7-amine is CN(C)C1C2CCC1CC2.
What is the InChIKey of N,N-dimethylbicyclo[2.2.1]heptan-7-amine?
The InChIKey is BDBXMEUWEKDUFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-10(2)9-7-3-4-8(9)6-5-7/h7-9H,3-6H2,1-2H3.
What are the key properties of N,N-dimethylbicyclo[2.2.1]heptan-7-amine?
N,N-dimethylbicyclo[2.2.1]heptan-7-amine has a molecular weight of 139.24 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylbicyclo[2.2.1]heptan-7-amine is sourced from PubChem (CID 58923790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).