6-bromo-N-cyclobutylnaphthalen-2-amine

C14H14BrN — CID 81260482

IUPAC6-bromo-N-cyclobutylnaphthalen-2-amine
SMILESBrc1ccc2cc(NC3CCC3)ccc2c1
InChIInChI=1S/C14H14BrN/c15-12-6-4-11-9-14(7-5-10(11)8-12)16-13-2-1-3-13/h4-9,13,16H,1-3H2
InChIKeyYRXDJGLFJWUGFV-UHFFFAOYSA-N
MW276.18 g/mol
LogP4.57
Rot. Bonds2

About 6-bromo-N-cyclobutylnaphthalen-2-amine

6-bromo-N-cyclobutylnaphthalen-2-amine (PubChem CID 81260482) has the molecular formula C14H14BrN and a molecular weight of 276.18 g/mol. Its IUPAC name is 6-bromo-N-cyclobutylnaphthalen-2-amine.

Molecular Properties

Compound Name6-bromo-N-cyclobutylnaphthalen-2-amine
PubChem CID81260482
Molecular FormulaC14H14BrN
Molecular Weight276.18 g/mol
Exact Mass275.03
IUPAC Name6-bromo-N-cyclobutylnaphthalen-2-amine
SMILESBrc1ccc2cc(NC3CCC3)ccc2c1
InChIInChI=1S/C14H14BrN/c15-12-6-4-11-9-14(7-5-10(11)8-12)16-13-2-1-3-13/h4-9,13,16H,1-3H2
InChIKeyYRXDJGLFJWUGFV-UHFFFAOYSA-N
XLogP4.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.18
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(6-bromonaphthalen-2-yl)oxan-4-amine
CID 81260159
2-[(6-bromonaphthalen-2-yl)amino]cyclopentan-1-ol
CID 81259521
3-N-(6-bromonaphthalen-2-yl)cyclopentane-1,3-diamine
CID 81260171
6-bromo-N-(2,3-dimethylcyclohexyl)naphthalen-2-amine
CID 81260243
N-(6-bromonaphthalen-2-yl)-1,5-dimethylpyrrolidin-3-amine
CID 81467875
N-(6-bromonaphthalen-2-yl)-2-propan-2-yloxan-4-amine
CID 81266205
4-bromo-1-N-cyclopentylbenzene-1,3-diamine
CID 82934286
2-bromo-6-cyclopentyloxynaphthalene
CID 63531133
1-[6-(cyclohexylamino)naphthalen-2-yl]ethanone
CID 121245244
6-bromo-N-[(3-methylcyclohexyl)methyl]naphthalen-2-amine
CID 81260489
2,6-dibromonaphthalene
CID 640591
N-cyclohexyl-1H-indol-6-amine
CID 139269794

Frequently Asked Questions

What is the IUPAC name of 6-bromo-N-cyclobutylnaphthalen-2-amine?
The IUPAC name of 6-bromo-N-cyclobutylnaphthalen-2-amine (CID 81260482) is 6-bromo-N-cyclobutylnaphthalen-2-amine.
What is the SMILES notation for 6-bromo-N-cyclobutylnaphthalen-2-amine?
The canonical SMILES for 6-bromo-N-cyclobutylnaphthalen-2-amine is Brc1ccc2cc(NC3CCC3)ccc2c1.
What is the InChIKey of 6-bromo-N-cyclobutylnaphthalen-2-amine?
The InChIKey is YRXDJGLFJWUGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrN/c15-12-6-4-11-9-14(7-5-10(11)8-12)16-13-2-1-3-13/h4-9,13,16H,1-3H2.
What are the key properties of 6-bromo-N-cyclobutylnaphthalen-2-amine?
6-bromo-N-cyclobutylnaphthalen-2-amine has a molecular weight of 276.18 g/mol, XLogP of 4.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-N-cyclobutylnaphthalen-2-amine is sourced from PubChem (CID 81260482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).