1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine

C17H17NO — CID 61079024

IUPAC1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
SMILESCc1ccoc1C(N)Cc1cccc2ccccc12
InChIInChI=1S/C17H17NO/c1-12-9-10-19-17(12)16(18)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,16H,11,18H2,1H3
InChIKeyGTUKAWZZIWCMHF-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.98
Rot. Bonds3

About 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine

1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine (PubChem CID 61079024) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
PubChem CID61079024
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC Name1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
SMILESCc1ccoc1C(N)Cc1cccc2ccccc12
InChIInChI=1S/C17H17NO/c1-12-9-10-19-17(12)16(18)11-14-7-4-6-13-5-2-3-8-15(13)14/h2-10,16H,11,18H2,1H3
InChIKeyGTUKAWZZIWCMHF-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-(furan-2-yl)-2-naphthalen-1-ylethanamine
CID 61079401
1-(3-methylfuran-2-yl)-2-phenylethanamine
CID 61078451
1-(5-methylfuran-2-yl)-2-naphthalen-1-ylethanamine
CID 61079585
1-(3-methylfuran-2-yl)-2-naphthalen-2-ylethanamine
CID 61077731
2-(furan-2-yl)-1-(3-methylfuran-2-yl)ethanamine
CID 104804301
1-(3,5-dimethylphenyl)-2-naphthalen-1-ylethanamine
CID 63527361
1-(2-methylpyrimidin-4-yl)-2-naphthalen-1-ylethanamine
CID 115530277
1-(5-methylthiophen-2-yl)-2-naphthalen-1-ylethanamine
CID 61079214
1-(4-fluoro-3-methylphenyl)-2-naphthalen-1-ylethanamine
CID 62600642
(2S)-1-naphthalen-1-ylbutan-2-amine
CID 178163209
(2R)-2-methyl-3-naphthalen-1-ylpropan-1-amine
CID 37134613
(2S)-1-naphthalen-1-ylpropane-2-sulfonamide
CID 125482966

Frequently Asked Questions

What is the IUPAC name of 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The IUPAC name of 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine (CID 61079024) is 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The canonical SMILES for 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine is Cc1ccoc1C(N)Cc1cccc2ccccc12.
What is the InChIKey of 1-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
The InChIKey is GTUKAWZZIWCMHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c1-12-9-10-19-17(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-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine?
1-(3-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-(3-methylfuran-2-yl)-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 61079024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).