2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine

C17H22N4O2 — CID 112886621

IUPAC2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine
SMILESCC(C)Oc1ccccc1Nc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C17H22N4O2/c1-13(2)23-15-6-4-3-5-14(15)19-16-7-8-18-17(20-16)21-9-11-22-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,18,19,20)
InChIKeyOXOZKBGEUGIBJR-UHFFFAOYSA-N
MW314.39 g/mol
LogP2.84
Rot. Bonds5

About 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine

2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine (PubChem CID 112886621) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine
PubChem CID112886621
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine
SMILESCC(C)Oc1ccccc1Nc1ccnc(N2CCOCC2)n1
InChIInChI=1S/C17H22N4O2/c1-13(2)23-15-6-4-3-5-14(15)19-16-7-8-18-17(20-16)21-9-11-22-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,18,19,20)
InChIKeyOXOZKBGEUGIBJR-UHFFFAOYSA-N
XLogP2.84
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-morpholin-4-yl-N-(2-morpholin-4-ylphenyl)pyrimidin-4-amine
CID 112886633
2-[(2-morpholin-4-ylpyrimidin-4-yl)amino]benzoic acid
CID 698340
N-(2-ethoxyphenyl)-2-piperidin-1-ylpyrimidin-4-amine
CID 112884703
N-(2-propan-2-ylphenyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)pyrimidin-4-amine
CID 112899006
methyl 2-[4-[(2-morpholin-4-ylpyrimidin-4-yl)amino]naphthalen-1-yl]-2-oxoacetate
CID 59379827
N-(2-propan-2-yloxyphenyl)-4-pyrrolidin-1-ylpyrimidin-2-amine
CID 112883925
4-N-(2-morpholin-4-ylphenyl)-2-N-propan-2-ylpyrimidine-2,4-diamine
CID 112882201
2-(3-methylpiperidin-1-yl)-N-(2-morpholin-4-ylphenyl)pyrimidin-4-amine
CID 112901131
4-N-(2-propan-2-yloxyphenyl)-2-N-propylpyrimidine-2,4-diamine
CID 112881959
4-N-(2-propan-2-yloxyphenyl)-2-N-quinolin-8-ylpyrimidine-2,4-diamine
CID 112905125
[4-[4-(2-methoxyanilino)pyrimidin-2-yl]piperazin-1-yl]-phenylmethanone
CID 134799674
N-(2-methoxyphenyl)-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935565

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine?
The IUPAC name of 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine (CID 112886621) is 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine is CC(C)Oc1ccccc1Nc1ccnc(N2CCOCC2)n1.
What is the InChIKey of 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine?
The InChIKey is OXOZKBGEUGIBJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-13(2)23-15-6-4-3-5-14(15)19-16-7-8-18-17(20-16)21-9-11-22-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,18,19,20).
What are the key properties of 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine?
2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine has a molecular weight of 314.39 g/mol, XLogP of 2.84, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(2-propan-2-yloxyphenyl)pyrimidin-4-amine is sourced from PubChem (CID 112886621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).