N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine

C11H21N7O2 — CID 114401570

IUPACN-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
SMILESCCN1CCOC(CNc2nc(NN)nc(OC)n2)C1
InChIInChI=1S/C11H21N7O2/c1-3-18-4-5-20-8(7-18)6-13-9-14-10(17-12)16-11(15-9)19-2/h8H,3-7,12H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyRXWGURIZXKYKRT-UHFFFAOYSA-N
MW283.34 g/mol
LogP-0.70
Rot. Bonds6

About N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine

N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine (PubChem CID 114401570) has the molecular formula C11H21N7O2 and a molecular weight of 283.34 g/mol. Its IUPAC name is N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
PubChem CID114401570
Molecular FormulaC11H21N7O2
Molecular Weight283.34 g/mol
Exact Mass283.18
IUPAC NameN-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine
SMILESCCN1CCOC(CNc2nc(NN)nc(OC)n2)C1
InChIInChI=1S/C11H21N7O2/c1-3-18-4-5-20-8(7-18)6-13-9-14-10(17-12)16-11(15-9)19-2/h8H,3-7,12H2,1-2H3,(H2,13,14,15,16,17)
InChIKeyRXWGURIZXKYKRT-UHFFFAOYSA-N
XLogP-0.70
TPSA110.45 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.34
LogP ≤ 5-0.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine (CID 114401570) is N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine is CCN1CCOC(CNc2nc(NN)nc(OC)n2)C1.
What is the InChIKey of N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine?
The InChIKey is RXWGURIZXKYKRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N7O2/c1-3-18-4-5-20-8(7-18)6-13-9-14-10(17-12)16-11(15-9)19-2/h8H,3-7,12H2,1-2H3,(H2,13,14,15,16,17).
What are the key properties of N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine?
N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine has a molecular weight of 283.34 g/mol, XLogP of -0.70, 6 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylmorpholin-2-yl)methyl]-4-hydrazinyl-6-methoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 114401570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).