2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol

C19H21N5O2 — CID 168928493

IUPAC2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol
SMILESCNc1cc(-c2cc(-c3cc(N)cnc3C)cc(OCCO)n2)ccn1
InChIInChI=1S/C19H21N5O2/c1-12-16(10-15(20)11-23-12)14-7-17(24-19(9-14)26-6-5-25)13-3-4-22-18(8-13)21-2/h3-4,7-11,25H,5-6,20H2,1-2H3,(H,21,22)
InChIKeyXZQSBAMWDLQGTG-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.51
Rot. Bonds6

About 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol

2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol (PubChem CID 168928493) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol.

Molecular Properties

Compound Name2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol
PubChem CID168928493
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol
SMILESCNc1cc(-c2cc(-c3cc(N)cnc3C)cc(OCCO)n2)ccn1
InChIInChI=1S/C19H21N5O2/c1-12-16(10-15(20)11-23-12)14-7-17(24-19(9-14)26-6-5-25)13-3-4-22-18(8-13)21-2/h3-4,7-11,25H,5-6,20H2,1-2H3,(H,21,22)
InChIKeyXZQSBAMWDLQGTG-UHFFFAOYSA-N
XLogP2.51
TPSA106.18 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Analyze 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol with MolForge

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Launch Full Analysis

Related Compounds

2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-(2-methoxy-4-pyridinyl)-2-pyridinyl]oxy]ethanol
CID 168928761
methyl N-[4-[6-(2-hydroxyethoxy)-4-[2-methyl-5-[[2-(1-methylazetidin-3-yl)acetyl]amino]-3-pyridinyl]-2-pyridinyl]-2-pyridinyl]carbamate
CID 170384754
2-[[4-(5-amino-4-fluoro-2-methylphenyl)-6-pyridin-4-yl-2-pyridinyl]oxy]ethanol
CID 168928786
2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[3-(fluoromethyl)oxetan-3-yl]-2-pyridinyl]oxy]ethanol
CID 134609520
N-[4-[4-[5-(ethylcarbamoylamino)-4-fluoro-2-methylphenyl]-6-(2-hydroxyethoxy)-2-pyridinyl]-2-pyridinyl]cyclopropanecarboxamide
CID 168928337
2,2,2-trichloroethyl N-[6-methyl-5-[4-[2-(methylamino)-4-pyridinyl]pyrimidin-2-yl]-3-pyridinyl]carbamate
CID 168928631
5-(4-chlorophenyl)-6-methylpyridin-3-amine
CID 165369043
6-methyl-5-[2-[2-(methylamino)-4-pyridinyl]pyrimidin-4-yl]-N-(2,2,2-trichloroethyl)pyridin-3-amine
CID 168928871
5-(5-amino-2-methyl-3-pyridinyl)pyrimidin-2-amine
CID 71070877
N-methyl-4-(2-methyl-4-pyridinyl)pyridin-2-amine
CID 130377079
methyl N-[4-[6-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-4-[2,4-difluoro-5-(2,2,2-trichloroethoxycarbonylamino)phenyl]-2-pyridinyl]-2-pyridinyl]carbamate
CID 170516560
N-[4-[4-(5-amino-2-methylphenyl)-6-cyclopropyl-2-pyridinyl]-2-pyridinyl]methanesulfonamide
CID 169024748

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol?
The IUPAC name of 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol (CID 168928493) is 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol.
What is the SMILES notation for 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol?
The canonical SMILES for 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol is CNc1cc(-c2cc(-c3cc(N)cnc3C)cc(OCCO)n2)ccn1.
What is the InChIKey of 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol?
The InChIKey is XZQSBAMWDLQGTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-12-16(10-15(20)11-23-12)14-7-17(24-19(9-14)26-6-5-25)13-3-4-22-18(8-13)21-2/h3-4,7-11,25H,5-6,20H2,1-2H3,(H,21,22).
What are the key properties of 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol?
2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol has a molecular weight of 351.41 g/mol, XLogP of 2.51, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(5-amino-2-methyl-3-pyridinyl)-6-[2-(methylamino)-4-pyridinyl]-2-pyridinyl]oxy]ethanol is sourced from PubChem (CID 168928493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).