N-(ethenyldiazenyl)-N-methylpropan-1-amine

C6H13N3 — CID 143405082

IUPACN-(ethenyldiazenyl)-N-methylpropan-1-amine
SMILESC=C/N=N/N(C)CCC
InChIInChI=1S/C6H13N3/c1-4-6-9(3)8-7-5-2/h5H,2,4,6H2,1,3H3/b8-7+
InChIKeyUXTZUGBTBQZPTP-BQYQJAHWSA-N
MW127.19 g/mol
LogP1.84
Rot. Bonds4

About N-(ethenyldiazenyl)-N-methylpropan-1-amine

N-(ethenyldiazenyl)-N-methylpropan-1-amine (PubChem CID 143405082) has the molecular formula C6H13N3 and a molecular weight of 127.19 g/mol. Its IUPAC name is N-(ethenyldiazenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound NameN-(ethenyldiazenyl)-N-methylpropan-1-amine
PubChem CID143405082
Molecular FormulaC6H13N3
Molecular Weight127.19 g/mol
Exact Mass127.11
IUPAC NameN-(ethenyldiazenyl)-N-methylpropan-1-amine
SMILESC=C/N=N/N(C)CCC
InChIInChI=1S/C6H13N3/c1-4-6-9(3)8-7-5-2/h5H,2,4,6H2,1,3H3/b8-7+
InChIKeyUXTZUGBTBQZPTP-BQYQJAHWSA-N
XLogP1.84
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.84
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of N-(ethenyldiazenyl)-N-methylpropan-1-amine?
The IUPAC name of N-(ethenyldiazenyl)-N-methylpropan-1-amine (CID 143405082) is N-(ethenyldiazenyl)-N-methylpropan-1-amine.
What is the SMILES notation for N-(ethenyldiazenyl)-N-methylpropan-1-amine?
The canonical SMILES for N-(ethenyldiazenyl)-N-methylpropan-1-amine is C=C/N=N/N(C)CCC.
What is the InChIKey of N-(ethenyldiazenyl)-N-methylpropan-1-amine?
The InChIKey is UXTZUGBTBQZPTP-BQYQJAHWSA-N. The full InChI is InChI=1S/C6H13N3/c1-4-6-9(3)8-7-5-2/h5H,2,4,6H2,1,3H3/b8-7+.
What are the key properties of N-(ethenyldiazenyl)-N-methylpropan-1-amine?
N-(ethenyldiazenyl)-N-methylpropan-1-amine has a molecular weight of 127.19 g/mol, XLogP of 1.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethenyldiazenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 143405082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).