1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine

C16H14BrNO — CID 105029613

IUPAC1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine
SMILESNC(Cc1ccco1)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H14BrNO/c17-14-6-5-11-8-13(4-3-12(11)9-14)16(18)10-15-2-1-7-19-15/h1-9,16H,10,18H2
InChIKeyRJRAJRJVXQJBAM-UHFFFAOYSA-N
MW316.20 g/mol
LogP4.44
Rot. Bonds3

About 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine

1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine (PubChem CID 105029613) has the molecular formula C16H14BrNO and a molecular weight of 316.20 g/mol. Its IUPAC name is 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine.

Molecular Properties

Compound Name1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine
PubChem CID105029613
Molecular FormulaC16H14BrNO
Molecular Weight316.20 g/mol
Exact Mass315.03
IUPAC Name1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine
SMILESNC(Cc1ccco1)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C16H14BrNO/c17-14-6-5-11-8-13(4-3-12(11)9-14)16(18)10-15-2-1-7-19-15/h1-9,16H,10,18H2
InChIKeyRJRAJRJVXQJBAM-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

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Related Compounds

1-(6-bromonaphthalen-2-yl)-2-(3-bromophenyl)ethanamine
CID 115354107
1-(5-bromo-2-chlorophenyl)-2-(furan-2-yl)ethanamine
CID 105029176
1-(6-bromonaphthalen-2-yl)-2-(3-methylphenyl)ethanamine
CID 115354108
6-bromo-N-[1-(furan-2-yl)propan-2-yl]naphthalen-2-amine
CID 81260554
1-(3,4-diethoxyphenyl)-2-(furan-2-yl)ethanamine
CID 105029319
1-(6-bromonaphthalen-2-yl)-2-propan-2-yloxyethanamine
CID 105013461
1-(6-bromonaphthalen-2-yl)-2-(2-methyl-1,3-thiazol-4-yl)ethanamine
CID 104997244
1-[5-bromo-2-(furan-2-ylmethylsulfanyl)phenyl]propan-2-amine
CID 114062128
1-(6-bromonaphthalen-2-yl)-4-methoxybutan-1-amine
CID 105055131
3-(furan-2-yl)-1-(2-methylquinolin-6-yl)propan-1-amine
CID 105172248
1-(2-bromo-3-methylphenyl)-2-(furan-2-yl)ethanamine
CID 107985336
(1S)-1-(3,4-dimethylphenyl)-3-(furan-2-yl)propan-1-amine
CID 40511217

Frequently Asked Questions

What is the IUPAC name of 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine?
The IUPAC name of 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine (CID 105029613) is 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine.
What is the SMILES notation for 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine?
The canonical SMILES for 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine is NC(Cc1ccco1)c1ccc2cc(Br)ccc2c1.
What is the InChIKey of 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine?
The InChIKey is RJRAJRJVXQJBAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrNO/c17-14-6-5-11-8-13(4-3-12(11)9-14)16(18)10-15-2-1-7-19-15/h1-9,16H,10,18H2.
What are the key properties of 1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine?
1-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine 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-(6-bromonaphthalen-2-yl)-2-(furan-2-yl)ethanamine is sourced from PubChem (CID 105029613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).