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

C16H14BrNO — CID 106854636

IUPAC1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine
SMILESNC(Cc1ccc2ccccc2c1)c1ccoc1Br
InChIInChI=1S/C16H14BrNO/c17-16-14(7-8-19-16)15(18)10-11-5-6-12-3-1-2-4-13(12)9-11/h1-9,15H,10,18H2
InChIKeyIFRBIEGQCYUMRD-UHFFFAOYSA-N
MW316.20 g/mol
LogP4.44
Rot. Bonds3

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

1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine (PubChem CID 106854636) has the molecular formula C16H14BrNO and a molecular weight of 316.20 g/mol. Its IUPAC name is 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine.

Molecular Properties

Compound Name1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine
PubChem CID106854636
Molecular FormulaC16H14BrNO
Molecular Weight316.20 g/mol
Exact Mass315.03
IUPAC Name1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine
SMILESNC(Cc1ccc2ccccc2c1)c1ccoc1Br
InChIInChI=1S/C16H14BrNO/c17-16-14(7-8-19-16)15(18)10-11-5-6-12-3-1-2-4-13(12)9-11/h1-9,15H,10,18H2
InChIKeyIFRBIEGQCYUMRD-UHFFFAOYSA-N
XLogP4.44
TPSA39.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.20
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-bromofuran-3-yl)-2-(3-chlorophenyl)ethanamine
CID 106854711
1-(3-methylfuran-2-yl)-2-naphthalen-2-ylethanamine
CID 61077731
1-(2-bromofuran-3-yl)-2-[3-(trifluoromethyl)phenyl]ethanamine
CID 106857204
1-(3-bromothiophen-2-yl)-2-naphthalen-2-ylethanamine
CID 63797585
1-(2-chloro-4-methylphenyl)-2-naphthalen-2-ylethanamine
CID 106861532
1-(2-bromofuran-3-yl)propan-1-amine
CID 103846080
1-(5-chloro-2-methylphenyl)-2-naphthalen-2-ylethanamine
CID 82871275
1-(2-bromofuran-3-yl)-3-(4-methoxyphenyl)propan-1-amine
CID 106857738
1-(3-bromo-5-fluorophenyl)-2-naphthalen-2-ylethanamine
CID 63528397
(2S)-3-naphthalen-2-ylpropane-1,2-diamine
CID 68655255
2-naphthalen-2-yl-1-pyrimidin-5-ylethanamine
CID 105118863
2-(3-bromophenyl)-1-(2-chlorofuran-3-yl)ethanamine
CID 106687863

Frequently Asked Questions

What is the IUPAC name of 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine?
The IUPAC name of 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine (CID 106854636) is 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine.
What is the SMILES notation for 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine?
The canonical SMILES for 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine is NC(Cc1ccc2ccccc2c1)c1ccoc1Br.
What is the InChIKey of 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine?
The InChIKey is IFRBIEGQCYUMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrNO/c17-16-14(7-8-19-16)15(18)10-11-5-6-12-3-1-2-4-13(12)9-11/h1-9,15H,10,18H2.
What are the key properties of 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine?
1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine has a molecular weight of 316.20 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromofuran-3-yl)-2-naphthalen-2-ylethanamine is sourced from PubChem (CID 106854636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).