N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine

C14H28N2 — CID 61232830

IUPACN-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCC(CC)N(CC)C1CC2CCC(C1)N2
InChIInChI=1S/C14H28N2/c1-4-13(5-2)16(6-3)14-9-11-7-8-12(10-14)15-11/h11-15H,4-10H2,1-3H3
InChIKeyJLFQXDOPDVLYFC-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.78
Rot. Bonds5

About N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine

N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine (PubChem CID 61232830) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine.

Molecular Properties

Compound NameN-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine
PubChem CID61232830
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC NameN-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine
SMILESCCC(CC)N(CC)C1CC2CCC(C1)N2
InChIInChI=1S/C14H28N2/c1-4-13(5-2)16(6-3)14-9-11-7-8-12(10-14)15-11/h11-15H,4-10H2,1-3H3
InChIKeyJLFQXDOPDVLYFC-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(1-cyclopropylpropan-2-yl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 113490124
N-ethyl-N-(1-phenylpropyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61232068
N-propan-2-yl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61232461
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]-N-pentan-3-ylpropanamide
CID 61230425
N-[1-(4-bromophenyl)propyl]-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61230921
N-ethyl-N-(2-ethylbutyl)-8-azabicyclo[3.2.1]octan-3-amine
CID 61231107
N-ethyl-N-[1-(4-ethylphenyl)ethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 61231866
N-ethyl-N-[1-(5-methylfuran-2-yl)ethyl]-8-azabicyclo[3.2.1]octan-3-amine
CID 61230349
2-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]-1-pyrrolidin-1-ylpropan-1-one
CID 61231358
1-[8-azabicyclo[3.2.1]octan-3-yl(ethyl)amino]propan-2-ol
CID 61231550
N-(cyclopropylmethyl)-N-ethyl-8-azabicyclo[3.2.1]octan-3-amine
CID 61233017
(1R,5S)-N-methyl-N-propyl-8-azabicyclo[3.2.1]octan-3-amine
CID 26189078

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine?
The IUPAC name of N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine (CID 61232830) is N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine.
What is the SMILES notation for N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine?
The canonical SMILES for N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine is CCC(CC)N(CC)C1CC2CCC(C1)N2.
What is the InChIKey of N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine?
The InChIKey is JLFQXDOPDVLYFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-13(5-2)16(6-3)14-9-11-7-8-12(10-14)15-11/h11-15H,4-10H2,1-3H3.
What are the key properties of N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine?
N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine has a molecular weight of 224.39 g/mol, XLogP of 2.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-pentan-3-yl-8-azabicyclo[3.2.1]octan-3-amine is sourced from PubChem (CID 61232830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).