N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine

C6H11N3 — CID 118983530

IUPACN-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine
SMILESC/C=N\N(C)N1C=CC1
InChIInChI=1S/C6H11N3/c1-3-7-8(2)9-5-4-6-9/h3-5H,6H2,1-2H3/b7-3-
InChIKeySFIQHQXLNHVAQW-CLTKARDFSA-N
MW125.17 g/mol
LogP0.67
Rot. Bonds2

About N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine

N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine (PubChem CID 118983530) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine.

Molecular Properties

Compound NameN-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine
PubChem CID118983530
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC NameN-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine
SMILESC/C=N\N(C)N1C=CC1
InChIInChI=1S/C6H11N3/c1-3-7-8(2)9-5-4-6-9/h3-5H,6H2,1-2H3/b7-3-
InChIKeySFIQHQXLNHVAQW-CLTKARDFSA-N
XLogP0.67
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', '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-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine?
The IUPAC name of N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine (CID 118983530) is N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine.
What is the SMILES notation for N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine?
The canonical SMILES for N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine is C/C=N\N(C)N1C=CC1.
What is the InChIKey of N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine?
The InChIKey is SFIQHQXLNHVAQW-CLTKARDFSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-7-8(2)9-5-4-6-9/h3-5H,6H2,1-2H3/b7-3-.
What are the key properties of N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine?
N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine has a molecular weight of 125.17 g/mol, XLogP of 0.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-ethylideneamino]-N-methyl-2H-azet-1-amine is sourced from PubChem (CID 118983530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).