(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol

C23H25ClN4O3 — CID 167429326

IUPAC(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol
SMILESCc1cc(Oc2cc(Cl)ccc2-c2ccc([C@@H](O)CN)cn2)cc(N2CCOCC2)n1
InChIInChI=1S/C23H25ClN4O3/c1-15-10-18(12-23(27-15)28-6-8-30-9-7-28)31-22-11-17(24)3-4-19(22)20-5-2-16(14-26-20)21(29)13-25/h2-5,10-12,14,21,29H,6-9,13,25H2,1H3/t21-/m0/s1
InChIKeyDMSUSXRDDRSGCF-NRFANRHFSA-N
MW440.93 g/mol
LogP3.73
Rot. Bonds6

About (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol

(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol (PubChem CID 167429326) has the molecular formula C23H25ClN4O3 and a molecular weight of 440.93 g/mol. Its IUPAC name is (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol.

Molecular Properties

Compound Name(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol
PubChem CID167429326
Molecular FormulaC23H25ClN4O3
Molecular Weight440.93 g/mol
Exact Mass440.16
IUPAC Name(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol
SMILESCc1cc(Oc2cc(Cl)ccc2-c2ccc([C@@H](O)CN)cn2)cc(N2CCOCC2)n1
InChIInChI=1S/C23H25ClN4O3/c1-15-10-18(12-23(27-15)28-6-8-30-9-7-28)31-22-11-17(24)3-4-19(22)20-5-2-16(14-26-20)21(29)13-25/h2-5,10-12,14,21,29H,6-9,13,25H2,1H3/t21-/m0/s1
InChIKeyDMSUSXRDDRSGCF-NRFANRHFSA-N
XLogP3.73
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500440.93
LogP ≤ 53.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol with MolForge

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Launch Full Analysis

Related Compounds

[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]methanamine
CID 167429110
4-[5-(1-aminoethyl)-2-pyridinyl]-3-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]benzonitrile
CID 167429814
4-[5-[(1S)-2-amino-1-hydroxyethyl]-2-pyridinyl]-3-[2-methyl-6-[(2S)-2-methylmorpholin-4-yl]pyrimidin-4-yl]oxybenzonitrile
CID 167429357
4-[5-[(1S)-2-amino-1-hydroxyethyl]-2-pyridinyl]-3-[(2-methyl-6-pyrimidin-2-yl-4-pyridinyl)oxy]benzonitrile
CID 167429922
4-[5-(3-fluoroazetidin-3-yl)-2-pyridinyl]-3-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]benzonitrile
CID 167429018
4-[4-(2-amino-1-hydroxyethyl)phenyl]-3-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)oxybenzonitrile
CID 167429138
4-[2-(2-amino-1-hydroxyethyl)-1,3-thiazol-4-yl]-3-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)oxybenzonitrile
CID 167429981
4-[8-(4-chloro-2-fluorophenyl)-3-methylpyrido[2,3-b]pyrazin-6-yl]morpholine
CID 157044800
benzyl (3R)-3-hydroxy-3-(6-morpholin-4-yl-3-pyridinyl)propanoate
CID 130196328
4-[2-[4-(5-chloro-2-pyridinyl)piperazin-1-yl]-6-methylpyrimidin-4-yl]morpholine
CID 166601129
2-(2-methyl-6-morpholin-4-ylpyrimidin-4-yl)oxyethanamine
CID 121206116
5-[4-(4-chloro-3-methylphenoxy)-6-morpholin-4-yl-2-pyridinyl]pyrimidin-2-amine
CID 157319144

Frequently Asked Questions

What is the IUPAC name of (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol?
The IUPAC name of (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol (CID 167429326) is (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol.
What is the SMILES notation for (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol?
The canonical SMILES for (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol is Cc1cc(Oc2cc(Cl)ccc2-c2ccc([C@@H](O)CN)cn2)cc(N2CCOCC2)n1.
What is the InChIKey of (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol?
The InChIKey is DMSUSXRDDRSGCF-NRFANRHFSA-N. The full InChI is InChI=1S/C23H25ClN4O3/c1-15-10-18(12-23(27-15)28-6-8-30-9-7-28)31-22-11-17(24)3-4-19(22)20-5-2-16(14-26-20)21(29)13-25/h2-5,10-12,14,21,29H,6-9,13,25H2,1H3/t21-/m0/s1.
What are the key properties of (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol?
(1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol has a molecular weight of 440.93 g/mol, XLogP of 3.73, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-amino-1-[6-[4-chloro-2-[(2-methyl-6-morpholin-4-yl-4-pyridinyl)oxy]phenyl]-3-pyridinyl]ethanol is sourced from PubChem (CID 167429326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).