3-amino-2,2-bis(3-bromophenyl)propan-1-ol

C15H15Br2NO — CID 129196579

IUPAC3-amino-2,2-bis(3-bromophenyl)propan-1-ol
SMILESNCC(CO)(c1cccc(Br)c1)c1cccc(Br)c1
InChIInChI=1S/C15H15Br2NO/c16-13-5-1-3-11(7-13)15(9-18,10-19)12-4-2-6-14(17)8-12/h1-8,19H,9-10,18H2
InChIKeyLYZAWRPKKVJMKB-UHFFFAOYSA-N
MW385.10 g/mol
LogP3.45
Rot. Bonds4

About 3-amino-2,2-bis(3-bromophenyl)propan-1-ol

3-amino-2,2-bis(3-bromophenyl)propan-1-ol (PubChem CID 129196579) has the molecular formula C15H15Br2NO and a molecular weight of 385.10 g/mol. Its IUPAC name is 3-amino-2,2-bis(3-bromophenyl)propan-1-ol.

Molecular Properties

Compound Name3-amino-2,2-bis(3-bromophenyl)propan-1-ol
PubChem CID129196579
Molecular FormulaC15H15Br2NO
Molecular Weight385.10 g/mol
Exact Mass382.95
IUPAC Name3-amino-2,2-bis(3-bromophenyl)propan-1-ol
SMILESNCC(CO)(c1cccc(Br)c1)c1cccc(Br)c1
InChIInChI=1S/C15H15Br2NO/c16-13-5-1-3-11(7-13)15(9-18,10-19)12-4-2-6-14(17)8-12/h1-8,19H,9-10,18H2
InChIKeyLYZAWRPKKVJMKB-UHFFFAOYSA-N
XLogP3.45
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.10
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-2-(3-bromophenyl)propan-1-ol
CID 66931490
3-amino-2-(3-bromophenyl)-1,1,1-trifluoropropan-2-ol
CID 84739096
(2R)-2-(3-bromophenyl)-2-fluoropropan-1-ol
CID 142383072
2-(3-bromophenyl)propan-2-ol;ethanol
CID 144557078
2-(3-bromophenyl)-2-(3,3-dimethylbutyl)propane-1,3-diol
CID 79448373
2-benzyl-2-(3-bromophenyl)propane-1,3-diol
CID 79447171
1-amino-1-(3-bromophenyl)propan-1-ol
CID 141222959
4-amino-4-(3-bromophenyl)pentan-1-ol
CID 116861781
2-(aminomethyl)-3-(3-bromophenyl)-2-(3-methylphenyl)propan-1-ol
CID 106507304
3-(3-bromophenyl)pentan-3-ol
CID 57443482
2-(3-bromophenyl)-1-methoxypropan-2-ol
CID 79566424
3-(aminomethyl)-2-(3-bromophenyl)pentan-2-ol
CID 79127279

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-bis(3-bromophenyl)propan-1-ol?
The IUPAC name of 3-amino-2,2-bis(3-bromophenyl)propan-1-ol (CID 129196579) is 3-amino-2,2-bis(3-bromophenyl)propan-1-ol.
What is the SMILES notation for 3-amino-2,2-bis(3-bromophenyl)propan-1-ol?
The canonical SMILES for 3-amino-2,2-bis(3-bromophenyl)propan-1-ol is NCC(CO)(c1cccc(Br)c1)c1cccc(Br)c1.
What is the InChIKey of 3-amino-2,2-bis(3-bromophenyl)propan-1-ol?
The InChIKey is LYZAWRPKKVJMKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2NO/c16-13-5-1-3-11(7-13)15(9-18,10-19)12-4-2-6-14(17)8-12/h1-8,19H,9-10,18H2.
What are the key properties of 3-amino-2,2-bis(3-bromophenyl)propan-1-ol?
3-amino-2,2-bis(3-bromophenyl)propan-1-ol has a molecular weight of 385.10 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-bis(3-bromophenyl)propan-1-ol is sourced from PubChem (CID 129196579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).