6-morpholin-4-ylpyrimidine-2,4-diamine

C8H13N5O — CID 13249216

IUPAC6-morpholin-4-ylpyrimidine-2,4-diamine
SMILESNc1cc(N2CCOCC2)nc(N)n1
InChIInChI=1S/C8H13N5O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2,(H4,9,10,11,12)
InChIKeyDFSFIKNJVGWSMU-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.52
Rot. Bonds1

About 6-morpholin-4-ylpyrimidine-2,4-diamine

6-morpholin-4-ylpyrimidine-2,4-diamine (PubChem CID 13249216) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is 6-morpholin-4-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name6-morpholin-4-ylpyrimidine-2,4-diamine
PubChem CID13249216
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name6-morpholin-4-ylpyrimidine-2,4-diamine
SMILESNc1cc(N2CCOCC2)nc(N)n1
InChIInChI=1S/C8H13N5O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2,(H4,9,10,11,12)
InChIKeyDFSFIKNJVGWSMU-UHFFFAOYSA-N
XLogP-0.52
TPSA90.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2,4-Diamino-6-piperidinopyrimidine
CID 606255
6-(4-Methylpiperazin-1-yl)pyrimidine-2,4-diamine
CID 753256
4-Chloro-6-(morpholin-4-yl)pyrimidin-2-amine
CID 1484288
4-(6-Chloropyrimidin-4-yl)morpholine
CID 796070
4-(4,6-Dichloropyrimidin-2-yl)morpholine
CID 2772068
4-chloro-N,N-dimethyl-6-morpholino-2-pyrimidinamine
CID 3424209
4-(4-Methylpiperazin-1-yl)-6-morpholin-4-ylpyrimidin-2-amine
CID 25130913
4-(2-Hydrazinylpyrimidin-4-yl)morpholine
CID 46779831
4-(2-Chloropyrimidin-4-yl)morpholine
CID 1714697
2-(2-Amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-ylamino)ethanol
CID 54587789
N-ethyl-2-(methylsulfanyl)-6-morpholino-4-pyrimidinamine
CID 1488170
2-Amino-4-morpholino-6-methylpyrimidine
CID 3642905

Frequently Asked Questions

What is the IUPAC name of 6-morpholin-4-ylpyrimidine-2,4-diamine?
The IUPAC name of 6-morpholin-4-ylpyrimidine-2,4-diamine (CID 13249216) is 6-morpholin-4-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 6-morpholin-4-ylpyrimidine-2,4-diamine?
The canonical SMILES for 6-morpholin-4-ylpyrimidine-2,4-diamine is Nc1cc(N2CCOCC2)nc(N)n1.
What is the InChIKey of 6-morpholin-4-ylpyrimidine-2,4-diamine?
The InChIKey is DFSFIKNJVGWSMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c9-6-5-7(12-8(10)11-6)13-1-3-14-4-2-13/h5H,1-4H2,(H4,9,10,11,12).
What are the key properties of 6-morpholin-4-ylpyrimidine-2,4-diamine?
6-morpholin-4-ylpyrimidine-2,4-diamine has a molecular weight of 195.23 g/mol, XLogP of -0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 13249216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).