N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine

C16H22N2O2 — CID 66393839

IUPACN-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine
SMILESCNC1c2ccccc2OCC1N1CC2CCC(C1)O2
InChIInChI=1S/C16H22N2O2/c1-17-16-13-4-2-3-5-15(13)19-10-14(16)18-8-11-6-7-12(9-18)20-11/h2-5,11-12,14,16-17H,6-10H2,1H3
InChIKeyYUISLQXLAZSOET-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.57
Rot. Bonds2

About N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine

N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine (PubChem CID 66393839) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine.

Molecular Properties

Compound NameN-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine
PubChem CID66393839
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine
SMILESCNC1c2ccccc2OCC1N1CC2CCC(C1)O2
InChIInChI=1S/C16H22N2O2/c1-17-16-13-4-2-3-5-15(13)19-10-14(16)18-8-11-6-7-12(9-18)20-11/h2-5,11-12,14,16-17H,6-10H2,1H3
InChIKeyYUISLQXLAZSOET-UHFFFAOYSA-N
XLogP1.57
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-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
N-methyl-3-(4-propan-2-ylpiperidin-1-yl)-3,4-dihydro-2H-chromen-4-amine
CID 103495167
3-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 65320847
3-N,4-N-dimethyl-3-N-[(1-methylpyrrolidin-3-yl)methyl]-3,4-dihydro-2H-chromene-3,4-diamine
CID 63276081
N-ethyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-2,3-dihydro-1H-inden-1-amine
CID 66391699
3-N,4-N-dimethyl-3-N-[(1-methylpyrrolidin-2-yl)methyl]-3,4-dihydro-2H-chromene-3,4-diamine
CID 79308760
3-(3,4-dimethylpyrrolidin-1-yl)-3,4-dihydro-2H-chromen-4-amine
CID 79189276
3-(3-methoxypyrrolidin-1-yl)-N-propyl-3,4-dihydro-2H-chromen-4-amine
CID 103532266
4-methyl-2-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115419081
ethane;N-methyl-3,4-dihydro-2H-chromen-4-amine
CID 143399161
6-cyclopropyl-N-[(3S,4R)-3-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3,4-dihydro-2H-chromen-4-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CID 156838104
3-(methylamino)-2,3,4,5-tetrahydro-1-benzoxepin-5-ol
CID 13446113

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine?
The IUPAC name of N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine (CID 66393839) is N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine.
What is the SMILES notation for N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine?
The canonical SMILES for N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine is CNC1c2ccccc2OCC1N1CC2CCC(C1)O2.
What is the InChIKey of N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine?
The InChIKey is YUISLQXLAZSOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-17-16-13-4-2-3-5-15(13)19-10-14(16)18-8-11-6-7-12(9-18)20-11/h2-5,11-12,14,16-17H,6-10H2,1H3.
What are the key properties of N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine?
N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine has a molecular weight of 274.36 g/mol, XLogP of 1.57, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)-3,4-dihydro-2H-chromen-4-amine is sourced from PubChem (CID 66393839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).