N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine

C12H20N6O — CID 80918086

IUPACN-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(NN)nc(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C12H20N6O/c1-2-19-12-15-10(17-13)14-11(16-12)18(9-5-6-9)7-8-3-4-8/h8-9H,2-7,13H2,1H3,(H,14,15,16,17)
InChIKeyBXMBUFAGBXNIEN-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.93
Rot. Bonds7

About N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine

N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine (PubChem CID 80918086) has the molecular formula C12H20N6O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine
PubChem CID80918086
Molecular FormulaC12H20N6O
Molecular Weight264.33 g/mol
Exact Mass264.17
IUPAC NameN-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCOc1nc(NN)nc(N(CC2CC2)C2CC2)n1
InChIInChI=1S/C12H20N6O/c1-2-19-12-15-10(17-13)14-11(16-12)18(9-5-6-9)7-8-3-4-8/h8-9H,2-7,13H2,1H3,(H,14,15,16,17)
InChIKeyBXMBUFAGBXNIEN-UHFFFAOYSA-N
XLogP0.93
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.93
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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Related Compounds

2-N-cyclopropyl-2-N-(cyclopropylmethyl)-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 80845232
N-cyclohexyl-4-ethoxy-N-ethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 80927598
N-cycloheptyl-4-ethoxy-6-hydrazinyl-N-methyl-1,3,5-triazin-2-amine
CID 80899497
2-N-cyclopropyl-2-N-(cyclopropylmethyl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80844355
4-ethoxy-6-hydrazinyl-N-methyl-N-(3-methylcyclohexyl)-1,3,5-triazin-2-amine
CID 80896501
2-N-(cyclopropylmethyl)-6-ethoxy-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80797891
2-N-cyclopropyl-6-ethoxy-2-N,4-N-dipropyl-1,3,5-triazine-2,4-diamine
CID 80774888
2-N-(cyclopropylmethyl)-6-ethoxy-4-N-ethyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 80820904
3-[[(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)amino]methyl]cyclopentan-1-ol
CID 114148716
4-ethoxy-6-hydrazinyl-N-methyl-N-(2-methylbutan-2-yl)-1,3,5-triazin-2-amine
CID 80913146
2-[(2-amino-2-oxoethyl)-(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)amino]acetamide
CID 80919652
2-N-(cyclohexylmethyl)-6-ethoxy-2-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80800038

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine?
The IUPAC name of N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine (CID 80918086) is N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine is CCOc1nc(NN)nc(N(CC2CC2)C2CC2)n1.
What is the InChIKey of N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine?
The InChIKey is BXMBUFAGBXNIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O/c1-2-19-12-15-10(17-13)14-11(16-12)18(9-5-6-9)7-8-3-4-8/h8-9H,2-7,13H2,1H3,(H,14,15,16,17).
What are the key properties of N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine?
N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine has a molecular weight of 264.33 g/mol, XLogP of 0.93, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(cyclopropylmethyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80918086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).