2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol

C10H13BrN2O — CID 104531645

IUPAC2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol
SMILESOCCN(c1cncc(Br)c1)C1CC1
InChIInChI=1S/C10H13BrN2O/c11-8-5-10(7-12-6-8)13(3-4-14)9-1-2-9/h5-7,9,14H,1-4H2
InChIKeyISDPRYDXRFKLQS-UHFFFAOYSA-N
MW257.13 g/mol
LogP1.81
Rot. Bonds4

About 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol

2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol (PubChem CID 104531645) has the molecular formula C10H13BrN2O and a molecular weight of 257.13 g/mol. Its IUPAC name is 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol.

Molecular Properties

Compound Name2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol
PubChem CID104531645
Molecular FormulaC10H13BrN2O
Molecular Weight257.13 g/mol
Exact Mass256.02
IUPAC Name2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol
SMILESOCCN(c1cncc(Br)c1)C1CC1
InChIInChI=1S/C10H13BrN2O/c11-8-5-10(7-12-6-8)13(3-4-14)9-1-2-9/h5-7,9,14H,1-4H2
InChIKeyISDPRYDXRFKLQS-UHFFFAOYSA-N
XLogP1.81
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.13
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-cyclopropyl-N-propylpyridin-3-amine
CID 104531553
2-[cyclopropyl-[5-(methylamino)-3-pyridinyl]amino]ethanol
CID 104533735
2-[(5-amino-3-pyridinyl)-cyclohexylamino]ethanol
CID 104533748
5-bromo-N-cyclopentyl-N-ethylpyridin-3-amine
CID 104531564
2-[(5-bromo-3-pyridinyl)methyl-cyclopropylamino]ethanol
CID 115586347
2-bromo-4-[cyclopentyl(2-hydroxyethyl)amino]benzaldehyde
CID 114060030
2-[(3-bromo-5-chloro-2-pyridinyl)-cyclohexylamino]ethanol
CID 114836476
3-[cyclobutyl-[5-(methylamino)-3-pyridinyl]amino]propan-1-ol
CID 102875578
2-[(3-bromo-4-pyridinyl)-cyclohexylamino]ethanol
CID 113452105
2-[3-bromo-N-cyclopentyl-4-(hydroxymethyl)anilino]ethanol
CID 114060297
5-bromo-N-(cyclopentylmethyl)-N-methylpyridin-3-amine
CID 115657325
3-[(5-bromo-3-pyridinyl)methyl-cyclobutylamino]propan-1-ol
CID 102848808

Frequently Asked Questions

What is the IUPAC name of 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol?
The IUPAC name of 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol (CID 104531645) is 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol.
What is the SMILES notation for 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol?
The canonical SMILES for 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol is OCCN(c1cncc(Br)c1)C1CC1.
What is the InChIKey of 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol?
The InChIKey is ISDPRYDXRFKLQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2O/c11-8-5-10(7-12-6-8)13(3-4-14)9-1-2-9/h5-7,9,14H,1-4H2.
What are the key properties of 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol?
2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol has a molecular weight of 257.13 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-bromo-3-pyridinyl)-cyclopropylamino]ethanol is sourced from PubChem (CID 104531645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).