2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine

C7H15N7 — CID 25242682

IUPAC2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
SMILESCCCCNc1nc(N)nc(NN)n1
InChIInChI=1S/C7H15N7/c1-2-3-4-10-6-11-5(8)12-7(13-6)14-9/h2-4,9H2,1H3,(H4,8,10,11,12,13,14)
InChIKeyOENJKSIJKLDQEZ-UHFFFAOYSA-N
MW197.25 g/mol
LogP-0.05
Rot. Bonds5

About 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine

2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine (PubChem CID 25242682) has the molecular formula C7H15N7 and a molecular weight of 197.25 g/mol. Its IUPAC name is 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
PubChem CID25242682
Molecular FormulaC7H15N7
Molecular Weight197.25 g/mol
Exact Mass197.14
IUPAC Name2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
SMILESCCCCNc1nc(N)nc(NN)n1
InChIInChI=1S/C7H15N7/c1-2-3-4-10-6-11-5(8)12-7(13-6)14-9/h2-4,9H2,1H3,(H4,8,10,11,12,13,14)
InChIKeyOENJKSIJKLDQEZ-UHFFFAOYSA-N
XLogP-0.05
TPSA114.77 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.25
LogP ≤ 5-0.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Launch Full Analysis

Related Compounds

2-N-butyl-1,3,5-triazine-2,4,6-triamine;pentane
CID 142941534
2-N,4-N-didecyl-1,3,5-triazine-2,4,6-triamine
CID 68586329
2-N,4-N-bis(2-aminoethyl)-6-N-butyl-1,3,5-triazine-2,4,6-triamine
CID 118119736
N-butyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931737
6-azido-2-N-butyl-1,3,5-triazine-2,4-diamine
CID 110189231
4-N-butyl-2-N-(4-tert-butylphenyl)-1,3,5-triazine-2,4,6-triamine
CID 101120334
4-hydrazinyl-N-pentyl-6-propoxy-1,3,5-triazin-2-amine
CID 80932221
4-N-butyl-2-methyl-1,2,3,5-tetrazin-2-ium-4,6-diamine
CID 146910951
3-[(4-amino-6-hydrazinyl-1,3,5-triazin-2-yl)amino]propanoic acid
CID 25243680
2-N-(3-aminopropyl)-1,3,5-triazine-2,4,6-triamine
CID 44590289
2-N-(4-anilinophenyl)-4-N-hexadecyl-1,3,5-triazine-2,4,6-triamine
CID 110189277
N-butyl-4,6-dichloro-1,3,5-triazin-2-amine
CID 139203727

Frequently Asked Questions

What is the IUPAC name of 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine (CID 25242682) is 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine is CCCCNc1nc(N)nc(NN)n1.
What is the InChIKey of 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
The InChIKey is OENJKSIJKLDQEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N7/c1-2-3-4-10-6-11-5(8)12-7(13-6)14-9/h2-4,9H2,1H3,(H4,8,10,11,12,13,14).
What are the key properties of 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine?
2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine has a molecular weight of 197.25 g/mol, XLogP of -0.05, 5 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 25242682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).