N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine

C10H18N6O — CID 80907357

IUPACN-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(N(C)C(C)C2CC2)n1
InChIInChI=1S/C10H18N6O/c1-6(7-4-5-7)16(2)9-12-8(15-11)13-10(14-9)17-3/h6-7H,4-5,11H2,1-3H3,(H,12,13,14,15)
InChIKeyYJVORDRYWKYKON-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.40
Rot. Bonds5

About N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine

N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine (PubChem CID 80907357) has the molecular formula C10H18N6O and a molecular weight of 238.29 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
PubChem CID80907357
Molecular FormulaC10H18N6O
Molecular Weight238.29 g/mol
Exact Mass238.15
IUPAC NameN-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCOc1nc(NN)nc(N(C)C(C)C2CC2)n1
InChIInChI=1S/C10H18N6O/c1-6(7-4-5-7)16(2)9-12-8(15-11)13-10(14-9)17-3/h6-7H,4-5,11H2,1-3H3,(H,12,13,14,15)
InChIKeyYJVORDRYWKYKON-UHFFFAOYSA-N
XLogP0.40
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine (CID 80907357) is N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine is COc1nc(NN)nc(N(C)C(C)C2CC2)n1.
What is the InChIKey of N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is YJVORDRYWKYKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6O/c1-6(7-4-5-7)16(2)9-12-8(15-11)13-10(14-9)17-3/h6-7H,4-5,11H2,1-3H3,(H,12,13,14,15).
What are the key properties of N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 238.29 g/mol, XLogP of 0.40, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80907357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).