1-(furan-2-yl)-2-naphthalen-1-ylethanamine

C16H15NO — CID 61079401

IUPAC1-(furan-2-yl)-2-naphthalen-1-ylethanamine
SMILESNC(Cc1cccc2ccccc12)c1ccco1
InChIInChI=1S/C16H15NO/c17-15(16-9-4-10-18-16)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10,15H,11,17H2
InChIKeyLPUDKNHAZRBGOX-UHFFFAOYSA-N
MW237.30 g/mol
LogP3.68
Rot. Bonds3

About 1-(furan-2-yl)-2-naphthalen-1-ylethanamine

1-(furan-2-yl)-2-naphthalen-1-ylethanamine (PubChem CID 61079401) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-(furan-2-yl)-2-naphthalen-1-ylethanamine.

Molecular Properties

Compound Name1-(furan-2-yl)-2-naphthalen-1-ylethanamine
PubChem CID61079401
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name1-(furan-2-yl)-2-naphthalen-1-ylethanamine
SMILESNC(Cc1cccc2ccccc12)c1ccco1
InChIInChI=1S/C16H15NO/c17-15(16-9-4-10-18-16)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10,15H,11,17H2
InChIKeyLPUDKNHAZRBGOX-UHFFFAOYSA-N
XLogP3.68
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-2-naphthalen-1-ylethanamine?
The IUPAC name of 1-(furan-2-yl)-2-naphthalen-1-ylethanamine (CID 61079401) is 1-(furan-2-yl)-2-naphthalen-1-ylethanamine.
What is the SMILES notation for 1-(furan-2-yl)-2-naphthalen-1-ylethanamine?
The canonical SMILES for 1-(furan-2-yl)-2-naphthalen-1-ylethanamine is NC(Cc1cccc2ccccc12)c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-2-naphthalen-1-ylethanamine?
The InChIKey is LPUDKNHAZRBGOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO/c17-15(16-9-4-10-18-16)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-10,15H,11,17H2.
What are the key properties of 1-(furan-2-yl)-2-naphthalen-1-ylethanamine?
1-(furan-2-yl)-2-naphthalen-1-ylethanamine has a molecular weight of 237.30 g/mol, XLogP of 3.68, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-2-naphthalen-1-ylethanamine is sourced from PubChem (CID 61079401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).