N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

C9H17N7O — CID 34253082

IUPACN-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C9H17N7O/c1-2-11-7-12-8(15-10)14-9(13-7)16-3-5-17-6-4-16/h2-6,10H2,1H3,(H2,11,12,13,14,15)
InChIKeyDHBVRQVHXJBMDQ-UHFFFAOYSA-N
MW239.28 g/mol
LogP-0.57
Rot. Bonds4

About N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine

N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 34253082) has the molecular formula C9H17N7O and a molecular weight of 239.28 g/mol. Its IUPAC name is N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID34253082
Molecular FormulaC9H17N7O
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC NameN-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C9H17N7O/c1-2-11-7-12-8(15-10)14-9(13-7)16-3-5-17-6-4-16/h2-6,10H2,1H3,(H2,11,12,13,14,15)
InChIKeyDHBVRQVHXJBMDQ-UHFFFAOYSA-N
XLogP-0.57
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

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-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 34253082) is N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is CCNc1nc(NN)nc(N2CCOCC2)n1.
What is the InChIKey of N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is DHBVRQVHXJBMDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N7O/c1-2-11-7-12-8(15-10)14-9(13-7)16-3-5-17-6-4-16/h2-6,10H2,1H3,(H2,11,12,13,14,15).
What are the key properties of N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine?
N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 239.28 g/mol, XLogP of -0.57, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 34253082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).