N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

C11H20N2 — CID 43131525

IUPACN-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NC1CC1)C2
InChIInChI=1S/C11H20N2/c1-13-10-4-5-11(13)7-9(6-10)12-8-2-3-8/h8-12H,2-7H2,1H3
InChIKeyVSLWOHZWBCHDKB-UHFFFAOYSA-N
MW180.29 g/mol
LogP1.36
Rot. Bonds2

About N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine

N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 43131525) has the molecular formula C11H20N2 and a molecular weight of 180.29 g/mol. Its IUPAC name is N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID43131525
Molecular FormulaC11H20N2
Molecular Weight180.29 g/mol
Exact Mass180.16
IUPAC NameN-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCN1C2CCC1CC(NC1CC1)C2
InChIInChI=1S/C11H20N2/c1-13-10-4-5-11(13)7-9(6-10)12-8-2-3-8/h8-12H,2-7H2,1H3
InChIKeyVSLWOHZWBCHDKB-UHFFFAOYSA-N
XLogP1.36
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.29
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine (CID 43131525) is N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is CN1C2CCC1CC(NC1CC1)C2.
What is the InChIKey of N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is VSLWOHZWBCHDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2/c1-13-10-4-5-11(13)7-9(6-10)12-8-2-3-8/h8-12H,2-7H2,1H3.
What are the key properties of N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine?
N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 180.29 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-8-methyl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 43131525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).