4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine

C17H32N2O — CID 66393072

IUPAC4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(CC)CC1N1CC2CCC(C1)O2
InChIInChI=1S/C17H32N2O/c1-3-9-18-16-8-5-13(4-2)10-17(16)19-11-14-6-7-15(12-19)20-14/h13-18H,3-12H2,1-2H3
InChIKeyIHOWWLCSLQJXPQ-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.80
Rot. Bonds5

About 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine

4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine (PubChem CID 66393072) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine.

Molecular Properties

Compound Name4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine
PubChem CID66393072
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine
SMILESCCCNC1CCC(CC)CC1N1CC2CCC(C1)O2
InChIInChI=1S/C17H32N2O/c1-3-9-18-16-8-5-13(4-2)10-17(16)19-11-14-6-7-15(12-19)20-14/h13-18H,3-12H2,1-2H3
InChIKeyIHOWWLCSLQJXPQ-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-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

2-(3,4-dimethoxypyrrolidin-1-yl)-4-ethyl-N-propylcyclohexan-1-amine
CID 103532460
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclopentan-1-amine
CID 66394027
4-ethyl-2-(4-methylpiperidin-1-yl)-N-propylcyclohexan-1-amine
CID 55192276
4-ethyl-2-[3-(methoxymethyl)pyrrolidin-1-yl]-N-propylcyclohexan-1-amine
CID 64570091
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-4-ethyl-N-propylcyclohexan-1-amine
CID 79928660
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-4-ethyl-N-methylcyclohexan-1-amine
CID 104958321
2-(azocan-1-yl)-N,4-diethylcyclohexan-1-amine
CID 63465174
N,4-diethyl-2-(4-propylpiperidin-1-yl)cyclohexan-1-amine
CID 63469848
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-4-ethyl-N-methylcyclohexan-1-amine
CID 113335646
N-[[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)cyclobutyl]methyl]propan-1-amine
CID 81005499
N,4-diethyl-2-(3-methoxypyrrolidin-1-yl)cyclohexan-1-amine
CID 103532122
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)-4-ethyl-N-propylcyclohexan-1-amine
CID 115561892

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine?
The IUPAC name of 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine (CID 66393072) is 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine.
What is the SMILES notation for 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine?
The canonical SMILES for 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine is CCCNC1CCC(CC)CC1N1CC2CCC(C1)O2.
What is the InChIKey of 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine?
The InChIKey is IHOWWLCSLQJXPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-3-9-18-16-8-5-13(4-2)10-17(16)19-11-14-6-7-15(12-19)20-14/h13-18H,3-12H2,1-2H3.
What are the key properties of 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine?
4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine has a molecular weight of 280.46 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclohexan-1-amine is sourced from PubChem (CID 66393072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).