N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine

C10H17N5O2 — CID 3080117

IUPACN-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine
SMILESCCCc1nc(NO)nc(N2CCOCC2)n1
InChIInChI=1S/C10H17N5O2/c1-2-3-8-11-9(14-16)13-10(12-8)15-4-6-17-7-5-15/h16H,2-7H2,1H3,(H,11,12,13,14)
InChIKeyCUCSHQORSGHSKV-UHFFFAOYSA-N
MW239.28 g/mol
LogP0.46
Rot. Bonds4

About N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine

N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine (PubChem CID 3080117) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine.

Molecular Properties

Compound NameN-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine
PubChem CID3080117
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC NameN-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine
SMILESCCCc1nc(NO)nc(N2CCOCC2)n1
InChIInChI=1S/C10H17N5O2/c1-2-3-8-11-9(14-16)13-10(12-8)15-4-6-17-7-5-15/h16H,2-7H2,1H3,(H,11,12,13,14)
InChIKeyCUCSHQORSGHSKV-UHFFFAOYSA-N
XLogP0.46
TPSA83.40 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(4-Morpholino-6-propyl-1,3,5-triazin-2-yl)aminoethanol
CID 130928
N-Cyclopropyl-6-(morpholin-4-yl)-4-propyl-1,3,5-triazin-2(1H)-imine
CID 192460
1,3,5-Triazin-2-amine, 4-methoxy-6-(4-morpholinylmethyl)-
CID 199954
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-
CID 3080120
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, (S)-
CID 3080129
2-Propanol, 1-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, (R)-
CID 3080130
1,3,5-Triazin-2(1H)-one, 4-(4-morpholinyl)-6-propyl-, dimethylhydrazone
CID 3080134
Acetamide, N-(4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)-
CID 3080135
Ethanol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, acetate (ester)
CID 3080158
Urea, N,N-dimethyl-N'-(4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)-
CID 3080162
Ethanol, 2-((4-(4-morpholinyl)-6-propyl-1,3,5-triazin-2-yl)amino)-, carbamate (ester)
CID 3080163
1,3,5-Triazin-2-amine, 4-(4-morpholinyl)-6-propyl-, monohydrochloride
CID 3080165

Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine?
The IUPAC name of N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine (CID 3080117) is N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine.
What is the SMILES notation for N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine?
The canonical SMILES for N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine is CCCc1nc(NO)nc(N2CCOCC2)n1.
What is the InChIKey of N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine?
The InChIKey is CUCSHQORSGHSKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-2-3-8-11-9(14-16)13-10(12-8)15-4-6-17-7-5-15/h16H,2-7H2,1H3,(H,11,12,13,14).
What are the key properties of N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine?
N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine has a molecular weight of 239.28 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-yl-6-propyl-1,3,5-triazin-2-yl)hydroxylamine is sourced from PubChem (CID 3080117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).