N-(2,5-dibromophenyl)oxolan-3-amine

C10H11Br2NO — CID 63335357

IUPACN-(2,5-dibromophenyl)oxolan-3-amine
SMILESBrc1ccc(Br)c(NC2CCOC2)c1
InChIInChI=1S/C10H11Br2NO/c11-7-1-2-9(12)10(5-7)13-8-3-4-14-6-8/h1-2,5,8,13H,3-4,6H2
InChIKeyGICFIAILBOICQV-UHFFFAOYSA-N
MW321.01 g/mol
LogP3.41
Rot. Bonds2

About N-(2,5-dibromophenyl)oxolan-3-amine

N-(2,5-dibromophenyl)oxolan-3-amine (PubChem CID 63335357) has the molecular formula C10H11Br2NO and a molecular weight of 321.01 g/mol. Its IUPAC name is N-(2,5-dibromophenyl)oxolan-3-amine.

Molecular Properties

Compound NameN-(2,5-dibromophenyl)oxolan-3-amine
PubChem CID63335357
Molecular FormulaC10H11Br2NO
Molecular Weight321.01 g/mol
Exact Mass318.92
IUPAC NameN-(2,5-dibromophenyl)oxolan-3-amine
SMILESBrc1ccc(Br)c(NC2CCOC2)c1
InChIInChI=1S/C10H11Br2NO/c11-7-1-2-9(12)10(5-7)13-8-3-4-14-6-8/h1-2,5,8,13H,3-4,6H2
InChIKeyGICFIAILBOICQV-UHFFFAOYSA-N
XLogP3.41
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.01
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-5-fluorophenyl)oxolan-3-amine
CID 107633205
N-(2-bromo-5-methylphenyl)oxolan-3-amine
CID 82761747
N-[2-bromo-5-(trifluoromethyl)phenyl]oxolan-3-amine
CID 114042727
4-bromo-2-(oxolan-3-ylamino)benzoic acid
CID 114907458
N-(2-bromo-4-fluorophenyl)oxolan-3-amine
CID 63331950
N-(2,5-dibromophenyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79895723
N-(3-bromo-2-methylphenyl)oxolan-3-amine
CID 115884928
N-(5-bromo-2-nitrosophenyl)oxan-4-amine
CID 170276803
N-(5-bromo-2-chlorophenyl)oxepan-4-amine
CID 65079704
2-fluoro-1-N-(oxolan-3-yl)benzene-1,4-diamine
CID 80716587
1-N-(2,5-dibromophenyl)cyclohexane-1,3-diamine
CID 79458952
N-(2-bromophenyl)oxan-4-amine;hydrochloride
CID 146049754

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dibromophenyl)oxolan-3-amine?
The IUPAC name of N-(2,5-dibromophenyl)oxolan-3-amine (CID 63335357) is N-(2,5-dibromophenyl)oxolan-3-amine.
What is the SMILES notation for N-(2,5-dibromophenyl)oxolan-3-amine?
The canonical SMILES for N-(2,5-dibromophenyl)oxolan-3-amine is Brc1ccc(Br)c(NC2CCOC2)c1.
What is the InChIKey of N-(2,5-dibromophenyl)oxolan-3-amine?
The InChIKey is GICFIAILBOICQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Br2NO/c11-7-1-2-9(12)10(5-7)13-8-3-4-14-6-8/h1-2,5,8,13H,3-4,6H2.
What are the key properties of N-(2,5-dibromophenyl)oxolan-3-amine?
N-(2,5-dibromophenyl)oxolan-3-amine has a molecular weight of 321.01 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dibromophenyl)oxolan-3-amine is sourced from PubChem (CID 63335357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).