N,6-dimethylbicyclo[3.2.0]heptan-3-amine

C9H17N — CID 129173155

IUPACN,6-dimethylbicyclo[3.2.0]heptan-3-amine
SMILESCNC1CC2CC(C)C2C1
InChIInChI=1S/C9H17N/c1-6-3-7-4-8(10-2)5-9(6)7/h6-10H,3-5H2,1-2H3
InChIKeyHVQRQTIFTHQFPW-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.64
Rot. Bonds1

About N,6-dimethylbicyclo[3.2.0]heptan-3-amine

N,6-dimethylbicyclo[3.2.0]heptan-3-amine (PubChem CID 129173155) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is N,6-dimethylbicyclo[3.2.0]heptan-3-amine.

Molecular Properties

Compound NameN,6-dimethylbicyclo[3.2.0]heptan-3-amine
PubChem CID129173155
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC NameN,6-dimethylbicyclo[3.2.0]heptan-3-amine
SMILESCNC1CC2CC(C)C2C1
InChIInChI=1S/C9H17N/c1-6-3-7-4-8(10-2)5-9(6)7/h6-10H,3-5H2,1-2H3
InChIKeyHVQRQTIFTHQFPW-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethylbicyclo[3.2.0]heptan-3-amine?
The IUPAC name of N,6-dimethylbicyclo[3.2.0]heptan-3-amine (CID 129173155) is N,6-dimethylbicyclo[3.2.0]heptan-3-amine.
What is the SMILES notation for N,6-dimethylbicyclo[3.2.0]heptan-3-amine?
The canonical SMILES for N,6-dimethylbicyclo[3.2.0]heptan-3-amine is CNC1CC2CC(C)C2C1.
What is the InChIKey of N,6-dimethylbicyclo[3.2.0]heptan-3-amine?
The InChIKey is HVQRQTIFTHQFPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-6-3-7-4-8(10-2)5-9(6)7/h6-10H,3-5H2,1-2H3.
What are the key properties of N,6-dimethylbicyclo[3.2.0]heptan-3-amine?
N,6-dimethylbicyclo[3.2.0]heptan-3-amine has a molecular weight of 139.24 g/mol, XLogP of 1.64, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethylbicyclo[3.2.0]heptan-3-amine is sourced from PubChem (CID 129173155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).