3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine

C14H15BrN2 — CID 82094286

IUPAC3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine
SMILESNCC(Cc1ccc(Br)cc1)c1ccccn1
InChIInChI=1S/C14H15BrN2/c15-13-6-4-11(5-7-13)9-12(10-16)14-3-1-2-8-17-14/h1-8,12H,9-10,16H2
InChIKeyADGSKLQZYOSIRL-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.13
Rot. Bonds4

About 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine

3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine (PubChem CID 82094286) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine
PubChem CID82094286
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine
SMILESNCC(Cc1ccc(Br)cc1)c1ccccn1
InChIInChI=1S/C14H15BrN2/c15-13-6-4-11(5-7-13)9-12(10-16)14-3-1-2-8-17-14/h1-8,12H,9-10,16H2
InChIKeyADGSKLQZYOSIRL-UHFFFAOYSA-N
XLogP3.13
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(4-bromophenyl)butan-2-yl]pyridine;hydrazine
CID 70296015
3-(4-ethoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 112509068
3-(4-propoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 83975865
3-(4-bromophenyl)-2-phenylpropan-1-amine
CID 65429656
3-(3-methylphenyl)-2-pyridin-2-ylpropan-1-amine
CID 82080996
4-(3-amino-2-pyridin-2-ylpropyl)-2-chlorophenol
CID 83975838
3-[4-[(3-methylphenyl)methoxy]phenyl]-2-pyridin-2-ylpropan-1-amine
CID 83975870
4-(3-amino-2-pyridin-2-ylpropyl)-2-ethoxyphenol
CID 83975818
3-phenyl-2-pyridin-2-ylpropan-1-ol
CID 68653958
3-(3,5-dichloro-4-ethoxyphenyl)-2-pyridin-2-ylpropan-1-amine
CID 83975851
2-[(1R)-1-bromo-2-phenylethyl]pyridine
CID 124909068
2-(4-bromophenyl)-3-(4-fluorophenyl)propan-1-amine
CID 79441901

Frequently Asked Questions

What is the IUPAC name of 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine?
The IUPAC name of 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine (CID 82094286) is 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine.
What is the SMILES notation for 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine?
The canonical SMILES for 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine is NCC(Cc1ccc(Br)cc1)c1ccccn1.
What is the InChIKey of 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine?
The InChIKey is ADGSKLQZYOSIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c15-13-6-4-11(5-7-13)9-12(10-16)14-3-1-2-8-17-14/h1-8,12H,9-10,16H2.
What are the key properties of 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine?
3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine has a molecular weight of 291.19 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-bromophenyl)-2-pyridin-2-ylpropan-1-amine is sourced from PubChem (CID 82094286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).