6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine

C13H22N4O2 — CID 66324992

IUPAC6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCCN2CCOCC2)c1C
InChIInChI=1S/C13H22N4O2/c1-11-12(15-10-16-13(11)18-2)14-4-3-5-17-6-8-19-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16)
InChIKeyZQWJBLCOFULSHM-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.93
Rot. Bonds6

About 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine

6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine (PubChem CID 66324992) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
PubChem CID66324992
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCCN2CCOCC2)c1C
InChIInChI=1S/C13H22N4O2/c1-11-12(15-10-16-13(11)18-2)14-4-3-5-17-6-8-19-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16)
InChIKeyZQWJBLCOFULSHM-UHFFFAOYSA-N
XLogP0.93
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-methoxy-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 66325980
6-chloro-5-ethyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 63729586
3-(2,4-dimethoxypyrimidin-5-yl)-N-(3-morpholin-4-ylpropyl)pyrazin-2-amine
CID 126471335
N-hexyl-6-methoxy-5-methylpyrimidin-4-amine
CID 66325235
N-[(4,6-dimethoxypyrimidin-5-yl)methyl]-2-morpholin-4-ylethanamine
CID 43552214
6-methoxy-5-methyl-N-propylpyrimidin-4-amine
CID 66326211
1-methyl-N-(3-morpholin-4-ylpropyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 22590085
6-chloro-N-(3-morpholin-4-ylpropyl)-5-propan-2-ylpyrimidin-4-amine
CID 63729585
N-cyclopropyl-N'-(6-methoxy-5-methylpyrimidin-4-yl)propane-1,3-diamine
CID 66332349
4,6-dimethoxy-5-N-methyl-2-N-(3-morpholin-4-ylpropyl)pyrimidine-2,5-diamine
CID 143380800
5-bromo-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine
CID 66341208
6-(2-methylquinolin-8-yl)oxy-4-N-(3-morpholin-4-ylpropyl)pyrimidine-4,5-diamine
CID 19141900

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine (CID 66324992) is 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine is COc1ncnc(NCCCN2CCOCC2)c1C.
What is the InChIKey of 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine?
The InChIKey is ZQWJBLCOFULSHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-11-12(15-10-16-13(11)18-2)14-4-3-5-17-6-8-19-9-7-17/h10H,3-9H2,1-2H3,(H,14,15,16).
What are the key properties of 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine?
6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine has a molecular weight of 266.34 g/mol, XLogP of 0.93, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-methyl-N-(3-morpholin-4-ylpropyl)pyrimidin-4-amine is sourced from PubChem (CID 66324992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).