1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine

C17H27NO — CID 105030037

IUPAC1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine
SMILESCNC(Cc1ccoc1)C1CCC2CCCCC2C1
InChIInChI=1S/C17H27NO/c1-18-17(10-13-8-9-19-12-13)16-7-6-14-4-2-3-5-15(14)11-16/h8-9,12,14-18H,2-7,10-11H2,1H3
InChIKeyNOHVXBKOGCCZDO-UHFFFAOYSA-N
MW261.41 g/mol
LogP4.02
Rot. Bonds4

About 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine

1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine (PubChem CID 105030037) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine.

Molecular Properties

Compound Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine
PubChem CID105030037
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine
SMILESCNC(Cc1ccoc1)C1CCC2CCCCC2C1
InChIInChI=1S/C17H27NO/c1-18-17(10-13-8-9-19-12-13)16-7-6-14-4-2-3-5-15(14)11-16/h8-9,12,14-18H,2-7,10-11H2,1H3
InChIKeyNOHVXBKOGCCZDO-UHFFFAOYSA-N
XLogP4.02
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine with MolForge

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Related Compounds

1-cyclobutyl-2-(furan-3-yl)-N-methylethanamine
CID 83175338
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(4-iodophenyl)-N-methylethanamine
CID 115864263
1-(4,4-dimethylcyclohexyl)-2-(furan-3-yl)-N-methylethanamine
CID 83174667
2-(furan-3-yl)-N-methyl-1-(4-propylcyclohexyl)ethanamine
CID 83175553
2-(furan-3-yl)-N-methyl-1-(5-methyloxolan-3-yl)ethanamine
CID 105030244
[1-cyclopropyl-2-(furan-3-yl)ethyl]hydrazine
CID 105202437
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(4-bromothiophen-2-yl)-N-methylethanamine
CID 115847876
N-ethyl-1-(3-ethylcyclopentyl)-2-(furan-3-yl)ethanamine
CID 83175352
N-[1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl(furan-3-yl)methyl]propan-1-amine
CID 115855420
1-cyclohexyl-3-(furan-3-yl)-1-methoxy-N-methylpropan-2-amine
CID 116771472
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-N-methyl-3-(1-methylpyrazol-4-yl)propan-1-amine
CID 103029639
1-(4-tert-butylcyclohexyl)-N-ethyl-2-(furan-3-yl)ethanamine
CID 83175651

Frequently Asked Questions

What is the IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine?
The IUPAC name of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine (CID 105030037) is 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine.
What is the SMILES notation for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine?
The canonical SMILES for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine is CNC(Cc1ccoc1)C1CCC2CCCCC2C1.
What is the InChIKey of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine?
The InChIKey is NOHVXBKOGCCZDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-18-17(10-13-8-9-19-12-13)16-7-6-14-4-2-3-5-15(14)11-16/h8-9,12,14-18H,2-7,10-11H2,1H3.
What are the key properties of 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine?
1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine has a molecular weight of 261.41 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)-2-(furan-3-yl)-N-methylethanamine is sourced from PubChem (CID 105030037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).