4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine

C13H23N7O — CID 80907174

IUPAC4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1CCCC1Nc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C13H23N7O/c1-9-3-2-4-10(9)15-11-16-12(19-14)18-13(17-11)20-5-7-21-8-6-20/h9-10H,2-8,14H2,1H3,(H2,15,16,17,18,19)
InChIKeyMIKDPNMYGFCXAQ-UHFFFAOYSA-N
MW293.38 g/mol
LogP0.59
Rot. Bonds4

About 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine

4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 80907174) has the molecular formula C13H23N7O and a molecular weight of 293.38 g/mol. Its IUPAC name is 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID80907174
Molecular FormulaC13H23N7O
Molecular Weight293.38 g/mol
Exact Mass293.20
IUPAC Name4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC1CCCC1Nc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C13H23N7O/c1-9-3-2-4-10(9)15-11-16-12(19-14)18-13(17-11)20-5-7-21-8-6-20/h9-10H,2-8,14H2,1H3,(H2,15,16,17,18,19)
InChIKeyMIKDPNMYGFCXAQ-UHFFFAOYSA-N
XLogP0.59
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.38
LogP ≤ 50.59
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 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 80907174) is 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC1CCCC1Nc1nc(NN)nc(N2CCOCC2)n1.
What is the InChIKey of 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is MIKDPNMYGFCXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N7O/c1-9-3-2-4-10(9)15-11-16-12(19-14)18-13(17-11)20-5-7-21-8-6-20/h9-10H,2-8,14H2,1H3,(H2,15,16,17,18,19).
What are the key properties of 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 293.38 g/mol, XLogP of 0.59, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(2-methylcyclopentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80907174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).