N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine

C15H30N2O — CID 66371772

IUPACN-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine
SMILESCCNC(CCN1CC2CCC(C1)O2)C(C)(C)C
InChIInChI=1S/C15H30N2O/c1-5-16-14(15(2,3)4)8-9-17-10-12-6-7-13(11-17)18-12/h12-14,16H,5-11H2,1-4H3
InChIKeyXSNVLKZUEXCVRZ-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.26
Rot. Bonds5

About N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine

N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine (PubChem CID 66371772) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine.

Molecular Properties

Compound NameN-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine
PubChem CID66371772
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine
SMILESCCNC(CCN1CC2CCC(C1)O2)C(C)(C)C
InChIInChI=1S/C15H30N2O/c1-5-16-14(15(2,3)4)8-9-17-10-12-6-7-13(11-17)18-12/h12-14,16H,5-11H2,1-4H3
InChIKeyXSNVLKZUEXCVRZ-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-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-ethyl-4,4-dimethyl-1-(4-propan-2-ylpiperidin-1-yl)pentan-3-amine
CID 103502662
1-(4-cyclopropylpiperazin-1-yl)-N-ethyl-4,4-dimethylpentan-3-amine
CID 62623024
2-(ethylamino)-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butanenitrile
CID 66371946
N,3,3-trimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)butan-2-amine
CID 66392098
N-ethyl-5-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-2-amine
CID 66391705
1-(1,1-dioxo-1,4-thiazinan-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
CID 62624613
N-ethyl-4,4-dimethyl-1-(3-propoxypiperidin-1-yl)pentan-3-amine
CID 62624096
3-(3,3-diethoxypropyl)-8-oxa-3-azabicyclo[3.2.1]octane
CID 66391359
N-ethyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)propan-1-amine
CID 66393443
4,4-dimethyl-N-propyl-1-(3,4,5-trimethylpiperazin-1-yl)pentan-3-amine
CID 114539613
1-(2,5-dimethylmorpholin-4-yl)-N-ethyl-4,4-dimethylpentan-3-amine
CID 62625316
3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propan-2-ylpropan-1-amine
CID 66391696

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine?
The IUPAC name of N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine (CID 66371772) is N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine.
What is the SMILES notation for N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine?
The canonical SMILES for N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine is CCNC(CCN1CC2CCC(C1)O2)C(C)(C)C.
What is the InChIKey of N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine?
The InChIKey is XSNVLKZUEXCVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-5-16-14(15(2,3)4)8-9-17-10-12-6-7-13(11-17)18-12/h12-14,16H,5-11H2,1-4H3.
What are the key properties of N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine?
N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine has a molecular weight of 254.42 g/mol, XLogP of 2.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4,4-dimethyl-1-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pentan-3-amine is sourced from PubChem (CID 66371772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).