1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine

C17H17NO — CID 61079585

IUPAC1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
SMILESCc1ccc(C(N)Cc2cccc3ccccc23)o1
InChIInChI=1S/C17H17NO/c1-12-9-10-17(19-12)16(18)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,16H,11,18H2,1H3
InChIKeyRHGRYJMHZCGIGL-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.98
Rot. Bonds3

About 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine

1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine (PubChem CID 61079585) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
PubChem CID61079585
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
SMILESCc1ccc(C(N)Cc2cccc3ccccc23)o1
InChIInChI=1S/C17H17NO/c1-12-9-10-17(19-12)16(18)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,16H,11,18H2,1H3
InChIKeyRHGRYJMHZCGIGL-UHFFFAOYSA-N
XLogP3.98
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
CID 61079024
1-(furan-2-yl)-2-naphthalen-1-ylethanamine
CID 61079401
1-(3,5-dimethylphenyl)-2-naphthalen-1-ylethanamine
CID 63527361
1-(5-methylthiophen-2-yl)-2-naphthalen-1-ylethanamine
CID 61079214
1-(2-methylpyrimidin-4-yl)-2-naphthalen-1-ylethanamine
CID 115530277
(2S)-1-naphthalen-1-ylbutan-2-amine
CID 178163209
(2R)-2-methyl-3-naphthalen-1-ylpropan-1-amine
CID 37134613
2-(4-fluoro-2-methylphenyl)-1-(5-methylfuran-2-yl)ethanamine
CID 105051024
1-(5-methylthiophen-3-yl)-2-naphthalen-1-ylethanamine
CID 105155456
2-naphthalen-1-yl-1-pyridin-4-ylethanamine
CID 61079955
1-(4-fluoro-3-methylphenyl)-2-naphthalen-1-ylethanamine
CID 62600642
ethane;(1R)-1-(5-methylfuran-2-yl)propan-1-amine
CID 142856729

Frequently Asked Questions

What is the IUPAC name of 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The IUPAC name of 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine (CID 61079585) is 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The canonical SMILES for 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine is Cc1ccc(C(N)Cc2cccc3ccccc23)o1.
What is the InChIKey of 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The InChIKey is RHGRYJMHZCGIGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-12-9-10-17(19-12)16(18)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,16H,11,18H2,1H3.
What are the key properties of 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine has a molecular weight of 251.33 g/mol, XLogP of 3.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 61079585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).