N-diazenyl-N,3-dimethylbutan-2-amine

C6H15N3 — CID 146507208

IUPACN-diazenyl-N,3-dimethylbutan-2-amine
SMILES[H]/N=N/N(C)C(C)C(C)C
InChIInChI=1S/C6H15N3/c1-5(2)6(3)9(4)8-7/h5-7H,1-4H3/b8-7+
InChIKeyRHDNNIYCRUNXGM-BQYQJAHWSA-N
MW129.21 g/mol
LogP1.91
Rot. Bonds3

About N-diazenyl-N,3-dimethylbutan-2-amine

N-diazenyl-N,3-dimethylbutan-2-amine (PubChem CID 146507208) has the molecular formula C6H15N3 and a molecular weight of 129.21 g/mol. Its IUPAC name is N-diazenyl-N,3-dimethylbutan-2-amine.

Molecular Properties

Compound NameN-diazenyl-N,3-dimethylbutan-2-amine
PubChem CID146507208
Molecular FormulaC6H15N3
Molecular Weight129.21 g/mol
Exact Mass129.13
IUPAC NameN-diazenyl-N,3-dimethylbutan-2-amine
SMILES[H]/N=N/N(C)C(C)C(C)C
InChIInChI=1S/C6H15N3/c1-5(2)6(3)9(4)8-7/h5-7H,1-4H3/b8-7+
InChIKeyRHDNNIYCRUNXGM-BQYQJAHWSA-N
XLogP1.91
TPSA39.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.21
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-diazenyl-N-methylmethanamine
CID 15178355
sodium N-diazenyl-N-ethylethanamine
CID 172778091
(1-diazenyl-2-methylpropyl)diazene
CID 57086976
1-(3-aminophenyl)-N'-diazenyl-N'-methylmethanediamine
CID 142338398
CID 154406351
CID 154406351
(2S)-2-[diazenyl(sulfamoyl)amino]-3-methylbutanoic acid
CID 166780515
1-diazenylethanethiol
CID 173486196
4-chloro-N-diazenyl-N-methylaniline
CID 167081565
2-[diazenyl(oxido)amino]propan-2-ol
CID 163568258
N-diazenyl-2-methyl-N-(methylamino)propan-2-amine
CID 146512453
2,3-dimethylbutan-2-yldiazene
CID 130441706
N,2,3-trimethyl-N-[(2S)-3-methylbutan-2-yl]butan-2-amine
CID 158159432

Frequently Asked Questions

What is the IUPAC name of N-diazenyl-N,3-dimethylbutan-2-amine?
The IUPAC name of N-diazenyl-N,3-dimethylbutan-2-amine (CID 146507208) is N-diazenyl-N,3-dimethylbutan-2-amine.
What is the SMILES notation for N-diazenyl-N,3-dimethylbutan-2-amine?
The canonical SMILES for N-diazenyl-N,3-dimethylbutan-2-amine is [H]/N=N/N(C)C(C)C(C)C.
What is the InChIKey of N-diazenyl-N,3-dimethylbutan-2-amine?
The InChIKey is RHDNNIYCRUNXGM-BQYQJAHWSA-N. The full InChI is InChI=1S/C6H15N3/c1-5(2)6(3)9(4)8-7/h5-7H,1-4H3/b8-7+.
What are the key properties of N-diazenyl-N,3-dimethylbutan-2-amine?
N-diazenyl-N,3-dimethylbutan-2-amine has a molecular weight of 129.21 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-diazenyl-N,3-dimethylbutan-2-amine is sourced from PubChem (CID 146507208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).