(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol

C10H15BrN2O — CID 126988382

IUPAC(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol
SMILESCc1nc(NCC[C@@H](C)O)ccc1Br
InChIInChI=1S/C10H15BrN2O/c1-7(14)5-6-12-10-4-3-9(11)8(2)13-10/h3-4,7,14H,5-6H2,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyICQGRMAPRVDFAN-SSDOTTSWSA-N
MW259.15 g/mol
LogP2.34
Rot. Bonds4

About (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol

(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol (PubChem CID 126988382) has the molecular formula C10H15BrN2O and a molecular weight of 259.15 g/mol. Its IUPAC name is (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol.

Molecular Properties

Compound Name(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol
PubChem CID126988382
Molecular FormulaC10H15BrN2O
Molecular Weight259.15 g/mol
Exact Mass258.04
IUPAC Name(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol
SMILESCc1nc(NCC[C@@H](C)O)ccc1Br
InChIInChI=1S/C10H15BrN2O/c1-7(14)5-6-12-10-4-3-9(11)8(2)13-10/h3-4,7,14H,5-6H2,1-2H3,(H,12,13)/t7-/m1/s1
InChIKeyICQGRMAPRVDFAN-SSDOTTSWSA-N
XLogP2.34
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol with MolForge

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Related Compounds

2-[2-[(5-bromo-6-methyl-2-pyridinyl)amino]ethoxy]acetamide
CID 106239798
4-[(5-methyl-2-pyridinyl)amino]butan-2-ol
CID 64911264
6-(4-hydroxypentylamino)-2-methylpyridine-3-carboxylic acid
CID 106136497
5-bromo-6-methyl-N-(3-pyrrolidin-1-ylpropyl)pyridin-2-amine
CID 114046561
N-(5-bromo-6-methyl-2-pyridinyl)-N',N'-diethylpropane-1,3-diamine
CID 106544023
5-bromo-6-methyl-N-(2,2,3,3-tetramethylbutyl)pyridin-2-amine
CID 115148384
2-[(5-bromo-6-methyl-2-pyridinyl)amino]-1-thiophen-3-ylethanol
CID 113412276
5-bromo-6-methyl-N-[(4-methylphenyl)methyl]pyridin-2-amine
CID 58338424
5-bromo-6-methyl-N-[2-(4-methylcyclohexyl)ethyl]pyridin-2-amine
CID 114046569
3-amino-6-(3-hydroxybutylamino)pyridine-2-carbonitrile
CID 103468589
3-[(5-bromo-6-methyl-2-pyridinyl)amino]-2-hydroxy-2-methylpropanoic acid
CID 122061079
4-[(5-bromo-6-methyl-2-pyridinyl)-methylamino]butan-2-ol
CID 103915166

Frequently Asked Questions

What is the IUPAC name of (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol?
The IUPAC name of (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol (CID 126988382) is (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol.
What is the SMILES notation for (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol?
The canonical SMILES for (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol is Cc1nc(NCC[C@@H](C)O)ccc1Br.
What is the InChIKey of (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol?
The InChIKey is ICQGRMAPRVDFAN-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H15BrN2O/c1-7(14)5-6-12-10-4-3-9(11)8(2)13-10/h3-4,7,14H,5-6H2,1-2H3,(H,12,13)/t7-/m1/s1.
What are the key properties of (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol?
(2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol has a molecular weight of 259.15 g/mol, XLogP of 2.34, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-[(5-bromo-6-methyl-2-pyridinyl)amino]butan-2-ol is sourced from PubChem (CID 126988382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).