1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine

C12H12BrNO — CID 63948375

IUPAC1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine
SMILESCNC(c1ccoc1)c1cccc(Br)c1
InChIInChI=1S/C12H12BrNO/c1-14-12(10-5-6-15-8-10)9-3-2-4-11(13)7-9/h2-8,12,14H,1H3
InChIKeySFUYHVPOJUNJIN-UHFFFAOYSA-N
MW266.14 g/mol
LogP3.35
Rot. Bonds3

About 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine

1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine (PubChem CID 63948375) has the molecular formula C12H12BrNO and a molecular weight of 266.14 g/mol. Its IUPAC name is 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine
PubChem CID63948375
Molecular FormulaC12H12BrNO
Molecular Weight266.14 g/mol
Exact Mass265.01
IUPAC Name1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine
SMILESCNC(c1ccoc1)c1cccc(Br)c1
InChIInChI=1S/C12H12BrNO/c1-14-12(10-5-6-15-8-10)9-3-2-4-11(13)7-9/h2-8,12,14H,1H3
InChIKeySFUYHVPOJUNJIN-UHFFFAOYSA-N
XLogP3.35
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.14
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromophenyl)-1-(3,5-difluorophenyl)-N-methylmethanamine
CID 55115762
1-(4-fluoro-3-methylphenyl)-1-(furan-3-yl)-N-methylmethanamine
CID 63949186
1-(3-bromophenyl)-1-(3,4-dichlorophenyl)-N-methylmethanamine
CID 43486480
(3-bromophenyl)-(furan-3-yl)methanamine;methanethione
CID 143594440
1-(3-bromophenyl)-N-methyl-1-pyrimidin-5-ylmethanamine
CID 62491207
1-(3-bromophenyl)-1-(4-fluoro-3,5-dimethylphenyl)-N-methylmethanamine
CID 65299050
1-[4-(aminomethyl)phenyl]-1-(3-bromophenyl)-N-methylmethanamine
CID 116952245
1-(3-bromophenyl)-N-methyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanamine
CID 43480640
1-(2-bromofuran-3-yl)-1-(furan-3-yl)-N-methylmethanamine
CID 106857587
1-(3-bromophenyl)-N-methyl-1-(2-methylphenyl)methanamine
CID 60819031
1-(4-bromonaphthalen-1-yl)-1-(furan-3-yl)-N-methylmethanamine
CID 79597141
1-(3-bromophenyl)-1-(2,6-dimethoxyphenyl)-N-methylmethanamine
CID 116810308

Frequently Asked Questions

What is the IUPAC name of 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine (CID 63948375) is 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine is CNC(c1ccoc1)c1cccc(Br)c1.
What is the InChIKey of 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine?
The InChIKey is SFUYHVPOJUNJIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12BrNO/c1-14-12(10-5-6-15-8-10)9-3-2-4-11(13)7-9/h2-8,12,14H,1H3.
What are the key properties of 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine?
1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine has a molecular weight of 266.14 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-bromophenyl)-1-(furan-3-yl)-N-methylmethanamine is sourced from PubChem (CID 63948375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).