2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine

C19H23N5O2 — CID 168923707

IUPAC2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine
SMILESc1ccc(N2CCc3c(NC4COC4)nc(N4CCOCC4)nc32)cc1
InChIInChI=1S/C19H23N5O2/c1-2-4-15(5-3-1)24-7-6-16-17(20-14-12-26-13-14)21-19(22-18(16)24)23-8-10-25-11-9-23/h1-5,14H,6-13H2,(H,20,21,22)
InChIKeyYCGUFHPOIKBBMA-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.82
Rot. Bonds4

About 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine

2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine (PubChem CID 168923707) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine
PubChem CID168923707
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine
SMILESc1ccc(N2CCc3c(NC4COC4)nc(N4CCOCC4)nc32)cc1
InChIInChI=1S/C19H23N5O2/c1-2-4-15(5-3-1)24-7-6-16-17(20-14-12-26-13-14)21-19(22-18(16)24)23-8-10-25-11-9-23/h1-5,14H,6-13H2,(H,20,21,22)
InChIKeyYCGUFHPOIKBBMA-UHFFFAOYSA-N
XLogP1.82
TPSA62.75 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-(2-morpholin-4-yl-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)pyridin-2-one
CID 168923459
4-[4-(1-methylpyrrolidin-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-yl]morpholine
CID 168923447
ethane;4-(7-phenyl-4-piperidin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-2-yl)morpholine
CID 168923667
ethane;2-methyl-1-(2-morpholin-4-yl-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)propan-2-ol
CID 168923711
3-(2-morpholin-4-yl-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)phenol
CID 24890625
3-(4-chloro-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl)benzonitrile
CID 168923756
N-[4-cyclopropyl-3-(2-morpholin-4-yl-7-pyridin-3-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)butyl]benzamide
CID 90913713
N-[4-[4-(2-aminopyrimidin-5-yl)-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]phenyl]acetamide
CID 59244650
N-(2,3-dihydro-1H-inden-2-yl)-3-(2-morpholin-4-yl-7-pyridin-3-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl)benzamide
CID 59244252
2-morpholin-4-yl-N-(oxolan-2-ylmethyl)quinazolin-4-amine chloride
CID 53351083
4-(3-methoxyphenyl)-2-[[2-morpholin-4-yl-7-(4-sulfamoylphenyl)-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-yl]amino]benzenesulfonamide
CID 91462676
methyl 3-[4-(2-aminopyrimidin-5-yl)-2-morpholin-4-yl-5,6-dihydropyrrolo[2,3-d]pyrimidin-7-yl]benzoate
CID 59244356

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine (CID 168923707) is 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine is c1ccc(N2CCc3c(NC4COC4)nc(N4CCOCC4)nc32)cc1.
What is the InChIKey of 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine?
The InChIKey is YCGUFHPOIKBBMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-2-4-15(5-3-1)24-7-6-16-17(20-14-12-26-13-14)21-19(22-18(16)24)23-8-10-25-11-9-23/h1-5,14H,6-13H2,(H,20,21,22).
What are the key properties of 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine?
2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine has a molecular weight of 353.43 g/mol, XLogP of 1.82, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(oxetan-3-yl)-7-phenyl-5,6-dihydropyrrolo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 168923707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).