N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine

C11H23N3 — CID 90761815

IUPACN,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine
SMILESCN(C)CCN1C2CCC1CN(C)C2
InChIInChI=1S/C11H23N3/c1-12(2)6-7-14-10-4-5-11(14)9-13(3)8-10/h10-11H,4-9H2,1-3H3
InChIKeyZTUVGCBZRDFMKY-UHFFFAOYSA-N
MW197.33 g/mol
LogP0.33
Rot. Bonds3

About N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine

N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine (PubChem CID 90761815) has the molecular formula C11H23N3 and a molecular weight of 197.33 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine
PubChem CID90761815
Molecular FormulaC11H23N3
Molecular Weight197.33 g/mol
Exact Mass197.19
IUPAC NameN,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine
SMILESCN(C)CCN1C2CCC1CN(C)C2
InChIInChI=1S/C11H23N3/c1-12(2)6-7-14-10-4-5-11(14)9-13(3)8-10/h10-11H,4-9H2,1-3H3
InChIKeyZTUVGCBZRDFMKY-UHFFFAOYSA-N
XLogP0.33
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.33
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine?
The IUPAC name of N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine (CID 90761815) is N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine.
What is the SMILES notation for N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine?
The canonical SMILES for N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine is CN(C)CCN1C2CCC1CN(C)C2.
What is the InChIKey of N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine?
The InChIKey is ZTUVGCBZRDFMKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3/c1-12(2)6-7-14-10-4-5-11(14)9-13(3)8-10/h10-11H,4-9H2,1-3H3.
What are the key properties of N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine?
N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine has a molecular weight of 197.33 g/mol, XLogP of 0.33, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)ethanamine is sourced from PubChem (CID 90761815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).