2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine

C17H18BrN — CID 54919338

IUPAC2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
SMILESNC1(Cc2ccccc2Br)CCc2ccccc2C1
InChIInChI=1S/C17H18BrN/c18-16-8-4-3-7-15(16)12-17(19)10-9-13-5-1-2-6-14(13)11-17/h1-8H,9-12,19H2
InChIKeyYNZBDFQHQYUZLZ-UHFFFAOYSA-N
MW316.24 g/mol
LogP3.88
Rot. Bonds2

About 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine

2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine (PubChem CID 54919338) has the molecular formula C17H18BrN and a molecular weight of 316.24 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine.

Molecular Properties

Compound Name2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
PubChem CID54919338
Molecular FormulaC17H18BrN
Molecular Weight316.24 g/mol
Exact Mass315.06
IUPAC Name2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
SMILESNC1(Cc2ccccc2Br)CCc2ccccc2C1
InChIInChI=1S/C17H18BrN/c18-16-8-4-3-7-15(16)12-17(19)10-9-13-5-1-2-6-14(13)11-17/h1-8H,9-12,19H2
InChIKeyYNZBDFQHQYUZLZ-UHFFFAOYSA-N
XLogP3.88
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.24
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2-bromophenyl)methyl]cyclooctan-1-amine
CID 80603079
2-[(2-bromo-5-fluorophenyl)methyl]-1,3-dihydroinden-2-amine
CID 62621612
2-(1-benzothiophen-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 63738278
2-[(5-fluoro-2-methylphenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine
CID 105373089
2-(aminomethyl)-3,4-dihydro-1H-naphthalen-2-amine;dichloroplatinum
CID 19741694
1-[(2-bromophenyl)methyl]-3,4-dimethylcyclohexan-1-amine
CID 64733966
1-[(2-bromophenyl)methyl]-4-methylcycloheptan-1-amine
CID 65080509
1-[(2-bromophenyl)methyl]-3-ethylcyclopentan-1-amine
CID 64513879
(2-amino-5-bromo-3,4-dihydro-1H-naphthalen-2-yl)methanol
CID 58466784
2-(2-ethoxyethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 62621096
2-(pyridin-3-ylmethyl)-3,4-dihydro-1H-naphthalen-2-amine
CID 113446872
1-[(2-bromophenyl)methyl]-4-propylcycloheptan-1-amine
CID 65086943

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The IUPAC name of 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine (CID 54919338) is 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine.
What is the SMILES notation for 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The canonical SMILES for 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine is NC1(Cc2ccccc2Br)CCc2ccccc2C1.
What is the InChIKey of 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
The InChIKey is YNZBDFQHQYUZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18BrN/c18-16-8-4-3-7-15(16)12-17(19)10-9-13-5-1-2-6-14(13)11-17/h1-8H,9-12,19H2.
What are the key properties of 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine?
2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine has a molecular weight of 316.24 g/mol, XLogP of 3.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methyl]-3,4-dihydro-1H-naphthalen-2-amine is sourced from PubChem (CID 54919338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).