4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine

C13H19N7O — CID 80902613

IUPAC4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCc1cccc(CNc2nc(NN)nc(OC(C)C)n2)n1
InChIInChI=1S/C13H19N7O/c1-8(2)21-13-18-11(17-12(19-13)20-14)15-7-10-6-4-5-9(3)16-10/h4-6,8H,7,14H2,1-3H3,(H2,15,17,18,19,20)
InChIKeyGQCBRKJYTUJROH-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.26
Rot. Bonds6

About 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine

4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 80902613) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID80902613
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCc1cccc(CNc2nc(NN)nc(OC(C)C)n2)n1
InChIInChI=1S/C13H19N7O/c1-8(2)21-13-18-11(17-12(19-13)20-14)15-7-10-6-4-5-9(3)16-10/h4-6,8H,7,14H2,1-3H3,(H2,15,17,18,19,20)
InChIKeyGQCBRKJYTUJROH-UHFFFAOYSA-N
XLogP1.26
TPSA110.87 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.26
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'}

Analyze 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-hydrazinyl-6-methoxy-N-[(6-methyl-2-pyridinyl)methyl]-1,3,5-triazin-2-amine
CID 80908132
4-hydrazinyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 80943161
4-hydrazinyl-N-[(2-methylphenyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80898763
6-methoxy-4-N-methyl-2-N-[(6-methyl-2-pyridinyl)methyl]-1,3,5-triazine-2,4-diamine
CID 80821680
4-hydrazinyl-6-propan-2-yloxy-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80944783
1-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]-2-methylpropan-2-ol
CID 80915056
N-(3-fluoro-2-methylphenyl)-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80900644
N-[(3-ethylthiophen-2-yl)methyl]-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80929885
N-tert-butyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80920133
N-(3-ethylpentan-2-yl)-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80910560
4-hydrazinyl-N-(3-methoxy-2-methylpropyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80907927
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
CID 80932481

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 80902613) is 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine is Cc1cccc(CNc2nc(NN)nc(OC(C)C)n2)n1.
What is the InChIKey of 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is GQCBRKJYTUJROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-8(2)21-13-18-11(17-12(19-13)20-14)15-7-10-6-4-5-9(3)16-10/h4-6,8H,7,14H2,1-3H3,(H2,15,17,18,19,20).
What are the key properties of 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine?
4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 1.26, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80902613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).