N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine

C13H26N2 — CID 112681257

IUPACN-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
SMILESCCNC(CC)C1CC2CCC(C1)N2C
InChIInChI=1S/C13H26N2/c1-4-13(14-5-2)10-8-11-6-7-12(9-10)15(11)3/h10-14H,4-9H2,1-3H3
InChIKeyVJEDENZFAYSKHO-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds4

About N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine

N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine (PubChem CID 112681257) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
PubChem CID112681257
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
SMILESCCNC(CC)C1CC2CCC(C1)N2C
InChIInChI=1S/C13H26N2/c1-4-13(14-5-2)10-8-11-6-7-12(9-10)15(11)3/h10-14H,4-9H2,1-3H3
InChIKeyVJEDENZFAYSKHO-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)pent-4-yn-1-amine
CID 112681260
N-ethyl-1-(3-propan-2-ylcyclobutyl)propan-1-amine
CID 103565352
N-ethyl-2-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)butan-1-amine
CID 112681244
N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-2-(1,3-thiazol-5-yl)ethanamine
CID 112681282
N-ethyl-2-(1-ethylpyrazol-4-yl)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 115998211
N-ethyl-2-(2-ethyl-1,2,4-triazol-3-yl)-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethanamine
CID 115998241
1-cyclohexyl-N-ethylpropan-1-amine
CID 60817829
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-phenylmethyl]ethanamine
CID 112681259
2-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-N-propylbutan-1-amine
CID 112681595
2-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-N-propylbutan-1-amine
CID 112681381
N-methyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)nonan-1-amine
CID 115998056
[2-ethoxy-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)ethyl]hydrazine
CID 105265763

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine (CID 112681257) is N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine is CCNC(CC)C1CC2CCC(C1)N2C.
What is the InChIKey of N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine?
The InChIKey is VJEDENZFAYSKHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-4-13(14-5-2)10-8-11-6-7-12(9-10)15(11)3/h10-14H,4-9H2,1-3H3.
What are the key properties of N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine?
N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)propan-1-amine is sourced from PubChem (CID 112681257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).