6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine

C13H23N5O — CID 83027389

IUPAC6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NCC)cc(NN2CCOCC2)n1
InChIInChI=1S/C13H23N5O/c1-3-5-11-15-12(14-4-2)10-13(16-11)17-18-6-8-19-9-7-18/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyXRZZKUNCIYZCAE-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.52
Rot. Bonds6

About 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine

6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine (PubChem CID 83027389) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine.

Molecular Properties

Compound Name6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine
PubChem CID83027389
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine
SMILESCCCc1nc(NCC)cc(NN2CCOCC2)n1
InChIInChI=1S/C13H23N5O/c1-3-5-11-15-12(14-4-2)10-13(16-11)17-18-6-8-19-9-7-18/h10H,3-9H2,1-2H3,(H2,14,15,16,17)
InChIKeyXRZZKUNCIYZCAE-UHFFFAOYSA-N
XLogP1.52
TPSA62.31 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-tert-butyl-4-N-morpholin-4-yl-6-N-propylpyrimidine-4,6-diamine
CID 83034209
4-N-ethyl-6-N-methyl-2-propylpyrimidine-4,6-diamine
CID 80946507
[4-[[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]oxan-4-yl]methanol
CID 106301218
4-N-morpholin-4-yl-6-N-propylpyrimidine-4,6-diamine
CID 83027310
N-(6-propylpyrimidin-4-yl)morpholin-4-amine
CID 83026460
6-chloro-N-(3-morpholin-4-ylpropyl)-2-propylpyrimidin-4-amine
CID 80940890
6-N-ethyl-4-N-[(3-methoxyoxolan-3-yl)methyl]-2-propylpyrimidine-4,6-diamine
CID 104767328
4-N-morpholin-4-yl-2-N-propyl-6-(trifluoromethyl)pyrimidine-2,4-diamine
CID 114565646
4-[[[6-(methylamino)-2-propylpyrimidin-4-yl]amino]methyl]oxan-4-ol
CID 81132043
N-ethyl-2-propyl-6-(4-propylpiperazin-1-yl)pyrimidin-4-amine
CID 80940402
N-ethyl-6-methylsulfanyl-2-propylpyrimidin-4-amine
CID 80947430
6-N-ethyl-4-N,4-N-dimethyl-2-propylpyrimidine-4,6-diamine
CID 80946313

Frequently Asked Questions

What is the IUPAC name of 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine?
The IUPAC name of 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine (CID 83027389) is 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine.
What is the SMILES notation for 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine?
The canonical SMILES for 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine is CCCc1nc(NCC)cc(NN2CCOCC2)n1.
What is the InChIKey of 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine?
The InChIKey is XRZZKUNCIYZCAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-3-5-11-15-12(14-4-2)10-13(16-11)17-18-6-8-19-9-7-18/h10H,3-9H2,1-2H3,(H2,14,15,16,17).
What are the key properties of 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine?
6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine has a molecular weight of 265.36 g/mol, XLogP of 1.52, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-ethyl-4-N-morpholin-4-yl-2-propylpyrimidine-4,6-diamine is sourced from PubChem (CID 83027389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).