4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine

C23H26N4O — CID 95552034

IUPAC4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
SMILESCc1cc(N2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)nc(N)n1
InChIInChI=1S/C23H26N4O/c1-17-14-22(26-23(24)25-17)27-12-13-28-20(16-27)15-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,14,20-21H,12-13,15-16H2,1H3,(H2,24,25,26)/t20-/m0/s1
InChIKeyIIGLAUCIXAQMMW-FQEVSTJZSA-N
MW374.49 g/mol
LogP3.79
Rot. Bonds5

About 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine

4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine (PubChem CID 95552034) has the molecular formula C23H26N4O and a molecular weight of 374.49 g/mol. Its IUPAC name is 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
PubChem CID95552034
Molecular FormulaC23H26N4O
Molecular Weight374.49 g/mol
Exact Mass374.21
IUPAC Name4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
SMILESCc1cc(N2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)nc(N)n1
InChIInChI=1S/C23H26N4O/c1-17-14-22(26-23(24)25-17)27-12-13-28-20(16-27)15-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,14,20-21H,12-13,15-16H2,1H3,(H2,24,25,26)/t20-/m0/s1
InChIKeyIIGLAUCIXAQMMW-FQEVSTJZSA-N
XLogP3.79
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.49
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(2R)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
CID 95552033
4-(2-ethylmorpholin-4-yl)-6-methylpyrimidin-2-amine
CID 112726117
4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]pyrimidin-2-amine
CID 95551297
4-[(2S)-2-(2-bromophenyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
CID 95273837
N-ethyl-4-(2-ethylmorpholin-4-yl)-6-methylpyrimidin-2-amine
CID 80787774
4-[(2S)-2-(4-bromophenyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
CID 95584085
4-[(2S)-2-(3,4-dichlorophenyl)morpholin-4-yl]-6-methylpyrimidin-2-amine
CID 95175522
[4-(2,6-diaminopyrimidin-4-yl)morpholin-2-yl]methanol
CID 81217236
[2-(2-ethylmorpholin-4-yl)-6-methyl-4-pyridinyl]methanol
CID 113378726
4-methyl-6-[4-[[(S)-phenyl(pyridin-4-yl)methyl]amino]piperidin-1-yl]pyrimidin-2-amine
CID 97187975
4-methyl-6-[(2R)-2-[5-(methylamino)-2-pyridinyl]morpholin-4-yl]pyrimidin-2-amine
CID 95847850
[4-(6-amino-2-phenylpyrimidin-4-yl)morpholin-2-yl]methanol
CID 115915735

Frequently Asked Questions

What is the IUPAC name of 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine?
The IUPAC name of 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine (CID 95552034) is 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine.
What is the SMILES notation for 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine?
The canonical SMILES for 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine is Cc1cc(N2CCO[C@@H](CC(c3ccccc3)c3ccccc3)C2)nc(N)n1.
What is the InChIKey of 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine?
The InChIKey is IIGLAUCIXAQMMW-FQEVSTJZSA-N. The full InChI is InChI=1S/C23H26N4O/c1-17-14-22(26-23(24)25-17)27-12-13-28-20(16-27)15-21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,14,20-21H,12-13,15-16H2,1H3,(H2,24,25,26)/t20-/m0/s1.
What are the key properties of 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine?
4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine has a molecular weight of 374.49 g/mol, XLogP of 3.79, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S)-2-(2,2-diphenylethyl)morpholin-4-yl]-6-methylpyrimidin-2-amine is sourced from PubChem (CID 95552034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).