6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine

C15H12BrNO — CID 81260316

IUPAC6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine
SMILESBrc1ccc2cc(NCc3ccoc3)ccc2c1
InChIInChI=1S/C15H12BrNO/c16-14-3-1-13-8-15(4-2-12(13)7-14)17-9-11-5-6-18-10-11/h1-8,10,17H,9H2
InChIKeyKVZORUPJAZHSFH-UHFFFAOYSA-N
MW302.17 g/mol
LogP4.81
Rot. Bonds3

About 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine

6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine (PubChem CID 81260316) has the molecular formula C15H12BrNO and a molecular weight of 302.17 g/mol. Its IUPAC name is 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine.

Molecular Properties

Compound Name6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine
PubChem CID81260316
Molecular FormulaC15H12BrNO
Molecular Weight302.17 g/mol
Exact Mass301.01
IUPAC Name6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine
SMILESBrc1ccc2cc(NCc3ccoc3)ccc2c1
InChIInChI=1S/C15H12BrNO/c16-14-3-1-13-8-15(4-2-12(13)7-14)17-9-11-5-6-18-10-11/h1-8,10,17H,9H2
InChIKeyKVZORUPJAZHSFH-UHFFFAOYSA-N
XLogP4.81
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.17
LogP ≤ 54.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-3-fluoro-N-(furan-3-ylmethyl)aniline
CID 65435326
6-bromo-N-[(4-ethylphenyl)methyl]naphthalen-2-amine
CID 81266198
N-(furan-3-ylmethyl)-3,4-dimethylaniline
CID 63204332
4-bromo-2-fluoro-N-(furan-3-ylmethyl)aniline
CID 63203814
6-bromo-N-[(3-methylphenyl)methyl]naphthalen-2-amine
CID 81260326
N-(furan-3-ylmethyl)quinolin-6-amine
CID 63204697
6-bromo-N-[(4-bromo-5-chlorothiophen-2-yl)methyl]naphthalen-2-amine
CID 102836645
4-bromo-N-(furan-3-ylmethyl)-3-nitroaniline
CID 79768212
4-fluoro-N-(furan-3-ylmethyl)-3-methylaniline
CID 63204789
N-(furan-3-ylmethyl)-1,3-dihydro-2-benzofuran-5-amine
CID 115881537
N-(furan-3-ylmethyl)aniline
CID 18938795
4-N-(furan-3-ylmethyl)benzene-1,4-diamine;hydrochloride
CID 22486431

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine?
The IUPAC name of 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine (CID 81260316) is 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine.
What is the SMILES notation for 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine?
The canonical SMILES for 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine is Brc1ccc2cc(NCc3ccoc3)ccc2c1.
What is the InChIKey of 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine?
The InChIKey is KVZORUPJAZHSFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrNO/c16-14-3-1-13-8-15(4-2-12(13)7-14)17-9-11-5-6-18-10-11/h1-8,10,17H,9H2.
What are the key properties of 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine?
6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine has a molecular weight of 302.17 g/mol, XLogP of 4.81, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-(furan-3-ylmethyl)naphthalen-2-amine is sourced from PubChem (CID 81260316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).