2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine

C10H12N6O — CID 2816900

IUPAC2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine
SMILESNc1ncnc2nc(N3CCOCC3)ncc12
InChIInChI=1S/C10H12N6O/c11-8-7-5-12-10(15-9(7)14-6-13-8)16-1-3-17-4-2-16/h5-6H,1-4H2,(H2,11,12,13,14,15)
InChIKeyNVTQTWYSTVDQFX-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.16
Rot. Bonds1

About 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine

2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine (PubChem CID 2816900) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine.

Molecular Properties

Compound Name2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine
PubChem CID2816900
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine
SMILESNc1ncnc2nc(N3CCOCC3)ncc12
InChIInChI=1S/C10H12N6O/c11-8-7-5-12-10(15-9(7)14-6-13-8)16-1-3-17-4-2-16/h5-6H,1-4H2,(H2,11,12,13,14,15)
InChIKeyNVTQTWYSTVDQFX-UHFFFAOYSA-N
XLogP-0.16
TPSA90.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-(4,6-Dimorpholino-1,3,5-triazin-2-yl)pyrimidin-2-amine
CID 46202651
(2-(Morpholin-4-yl)pyrimidin-5-yl)methanamine
CID 42556097
2-Pyrrolidin-1-ylpyrimido[4,5-d]pyrimidin-5-amine
CID 2816958
2-(2-Methylpiperidin-1-yl)pyrimido[4,5-d]pyrimidine-5,7-diamine
CID 155551922
2-morpholin-4-yl-8H-pyrimido[4,5-d]pyrimidine-5,7-dithione
CID 5714965
2-N,2-N-dimethylpyrimido[4,5-d]pyrimidine-2,5-diamine
CID 86152770
N7,N7-dimethylpyrimido[4,5-d][1,3]diazine-2,4,7-triamine
CID 90969157
5-[5-(Difluoromethyl)-4,6-dimorpholin-4-ylpyrimidin-2-yl]pyrimidin-2-amine
CID 175844623
5-(4-Chloro-5-fluoro-6-morpholin-4-ylpyrimidin-2-yl)pyrimidin-2-amine
CID 178031123
2-(4-Methylpiperazin-1-yl)pyrimido[4,5-d]pyrimidin-5-amine
CID 85554148
7-Methylpyrimido[4,5-d]pyrimidine-2,4-diamine
CID 85735805
2-Piperazin-1-ylpyrimido[4,5-d]pyrimidine-5,7-diamine
CID 134987147

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine?
The IUPAC name of 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine (CID 2816900) is 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine.
What is the SMILES notation for 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine?
The canonical SMILES for 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine is Nc1ncnc2nc(N3CCOCC3)ncc12.
What is the InChIKey of 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine?
The InChIKey is NVTQTWYSTVDQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c11-8-7-5-12-10(15-9(7)14-6-13-8)16-1-3-17-4-2-16/h5-6H,1-4H2,(H2,11,12,13,14,15).
What are the key properties of 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine?
2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine has a molecular weight of 232.25 g/mol, XLogP of -0.16, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-ylpyrimido[4,5-d]pyrimidin-5-amine is sourced from PubChem (CID 2816900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).