N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine

C17H24N2O — CID 66391699

IUPACN-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1c2ccccc2CC1N1CC2CCC(C1)O2
InChIInChI=1S/C17H24N2O/c1-2-18-17-15-6-4-3-5-12(15)9-16(17)19-10-13-7-8-14(11-19)20-13/h3-6,13-14,16-18H,2,7-11H2,1H3
InChIKeyBYOBJNSCGJRJLP-UHFFFAOYSA-N
MW272.39 g/mol
LogP2.13
Rot. Bonds3

About N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine

N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine (PubChem CID 66391699) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine.

Molecular Properties

Compound NameN-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
PubChem CID66391699
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
SMILESCCNC1c2ccccc2CC1N1CC2CCC(C1)O2
InChIInChI=1S/C17H24N2O/c1-2-18-17-15-6-4-3-5-12(15)9-16(17)19-10-13-7-8-14(11-19)20-13/h3-6,13-14,16-18H,2,7-11H2,1H3
InChIKeyBYOBJNSCGJRJLP-UHFFFAOYSA-N
XLogP2.13
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine with MolForge

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Related Compounds

N-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 66392493
2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-ethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 104958357
2-(2,4-dimethylpiperidin-1-yl)-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 62331020
N-ethyl-2-(2-propylpiperidin-1-yl)-2,3-dihydro-1H-inden-1-amine
CID 83053543
N-ethyl-2-(oxan-4-ylmethyl)-2,3-dihydro-1H-inden-1-amine
CID 62385341
3-benzyl-N-ethyl-2-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 79736974
N-ethyl-2-(oxan-4-ylmethoxy)-2,3-dihydro-1H-inden-1-amine
CID 62384262
N-ethyl-4-methyl-2-(3-methylpyrrolidin-1-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115418929
2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-N-propylcyclopentan-1-amine
CID 66394027
2-(4-ethyl-4-methylpiperidin-1-yl)-N-methyl-2,3-dihydro-1H-inden-1-amine
CID 63160859
N-ethyl-2-(4-methylphenyl)sulfanyl-2,3-dihydro-1H-inden-1-amine
CID 64619862
2-(benzenesulfonyl)-N-ethyl-2,3-dihydro-1H-inden-1-amine
CID 62917722

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine?
The IUPAC name of N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine (CID 66391699) is N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine.
What is the SMILES notation for N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine?
The canonical SMILES for N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine is CCNC1c2ccccc2CC1N1CC2CCC(C1)O2.
What is the InChIKey of N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine?
The InChIKey is BYOBJNSCGJRJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-2-18-17-15-6-4-3-5-12(15)9-16(17)19-10-13-7-8-14(11-19)20-13/h3-6,13-14,16-18H,2,7-11H2,1H3.
What are the key properties of N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine?
N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine has a molecular weight of 272.39 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine is sourced from PubChem (CID 66391699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).