2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol

C14H17N3O2 — CID 43498862

IUPAC2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol
SMILESCOc1nc(NCC(O)c2ccccc2)ccc1N
InChIInChI=1S/C14H17N3O2/c1-19-14-11(15)7-8-13(17-14)16-9-12(18)10-5-3-2-4-6-10/h2-8,12,18H,9,15H2,1H3,(H,16,17)
InChIKeyMBRSIEVKUUVZKK-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.82
Rot. Bonds5

About 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol

2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol (PubChem CID 43498862) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol
PubChem CID43498862
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol
SMILESCOc1nc(NCC(O)c2ccccc2)ccc1N
InChIInChI=1S/C14H17N3O2/c1-19-14-11(15)7-8-13(17-14)16-9-12(18)10-5-3-2-4-6-10/h2-8,12,18H,9,15H2,1H3,(H,16,17)
InChIKeyMBRSIEVKUUVZKK-UHFFFAOYSA-N
XLogP1.82
TPSA80.40 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-methoxypyrimidin-4-yl)amino]-1-phenylethanol
CID 45242537
2-[(5-amino-6-methoxy-2-pyridinyl)amino]acetamide
CID 43260954
6-methoxy-2-N-[(2-methoxyphenyl)methyl]pyridine-2,5-diamine
CID 43260997
2-[(6-amino-2-ethylpyrimidin-4-yl)amino]-1-phenylethanol
CID 80933367
2-[(5-amino-6-propoxy-2-pyridinyl)amino]-1-thiophen-3-ylethanol
CID 106434587
6-methoxy-2-N-(naphthalen-1-ylmethyl)pyridine-2,5-diamine
CID 62369756
2-N-[(2-chlorophenyl)methyl]-6-methoxypyridine-2,5-diamine
CID 43261047
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-2-methylpropan-1-ol
CID 43498830
6-methoxy-2-N-(2,2,2-trifluoroethyl)pyridine-2,5-diamine
CID 43261093
(1S)-2-[(2-chloropyrimidin-4-yl)amino]-1-phenylethanol
CID 87737078
6-methoxy-2-N-(2-methyl-3-pyrrolidin-1-ylpropyl)pyridine-2,5-diamine
CID 62991684
2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]-1-phenylethanol
CID 80779813

Frequently Asked Questions

What is the IUPAC name of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol?
The IUPAC name of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol (CID 43498862) is 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol.
What is the SMILES notation for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol?
The canonical SMILES for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol is COc1nc(NCC(O)c2ccccc2)ccc1N.
What is the InChIKey of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol?
The InChIKey is MBRSIEVKUUVZKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-19-14-11(15)7-8-13(17-14)16-9-12(18)10-5-3-2-4-6-10/h2-8,12,18H,9,15H2,1H3,(H,16,17).
What are the key properties of 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol?
2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol has a molecular weight of 259.31 g/mol, XLogP of 1.82, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-amino-6-methoxy-2-pyridinyl)amino]-1-phenylethanol is sourced from PubChem (CID 43498862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).