N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine

C16H30N2O — CID 66371197

IUPACN-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C)CC1CN1CC2CCC(C1)O2
InChIInChI=1S/C16H30N2O/c1-3-17-16-7-4-12(2)8-13(16)9-18-10-14-5-6-15(11-18)19-14/h12-17H,3-11H2,1-2H3
InChIKeyFSUJUZKNXWEMHH-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.26
Rot. Bonds4

About N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine

N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine (PubChem CID 66371197) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine
PubChem CID66371197
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine
SMILESCCNC1CCC(C)CC1CN1CC2CCC(C1)O2
InChIInChI=1S/C16H30N2O/c1-3-17-16-7-4-12(2)8-13(16)9-18-10-14-5-6-15(11-18)19-14/h12-17H,3-11H2,1-2H3
InChIKeyFSUJUZKNXWEMHH-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine with MolForge

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Related Compounds

2-(azepan-1-ylmethyl)-N-ethyl-4-methylcyclohexan-1-amine
CID 62616066
1-[[2-(ethylamino)-5-methylcyclohexyl]methyl]-N,N,4-trimethylpyrrolidin-3-amine
CID 81474572
N-ethyl-4-methyl-2-(1,4-oxazepan-4-ylmethyl)cyclohexan-1-amine
CID 62972825
N-ethyl-2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-4-methylcyclohexan-1-amine
CID 64581779
2-[(4,4-dimethylazepan-1-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 65282251
2-[(2,5-dimethylmorpholin-4-yl)methyl]-N-ethyl-4-methylcyclohexan-1-amine
CID 62616102
N-ethyl-4-methyl-2-[(3,3,4-trimethylpiperazin-1-yl)methyl]cyclohexan-1-amine
CID 63620914
N-ethyl-2-[2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)ethyl]cyclopentan-1-amine
CID 79565380
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyloxolan-3-amine
CID 66371661
4-methyl-2-(piperidin-1-ylmethyl)-N-propylcyclohexan-1-amine
CID 62614642
[4-[[5-methyl-2-(propylamino)cyclohexyl]methyl]morpholin-2-yl]methanol
CID 81214226
N-ethyl-4-methyl-2-(oxolan-2-ylmethyl)cyclohexan-1-amine
CID 62549830

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine?
The IUPAC name of N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine (CID 66371197) is N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine.
What is the SMILES notation for N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine?
The canonical SMILES for N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine is CCNC1CCC(C)CC1CN1CC2CCC(C1)O2.
What is the InChIKey of N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine?
The InChIKey is FSUJUZKNXWEMHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-3-17-16-7-4-12(2)8-13(16)9-18-10-14-5-6-15(11-18)19-14/h12-17H,3-11H2,1-2H3.
What are the key properties of N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine?
N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine has a molecular weight of 266.43 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)cyclohexan-1-amine is sourced from PubChem (CID 66371197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).