N-[(E)-hexylideneamino]-N-methylmethanamine

C8H18N2 — CID 11309573

IUPACN-[(E)-hexylideneamino]-N-methylmethanamine
SMILESCCCCC/C=N/N(C)C
InChIInChI=1S/C8H18N2/c1-4-5-6-7-8-9-10(2)3/h8H,4-7H2,1-3H3/b9-8+
InChIKeyKEQDBBYEWHFSRW-CMDGGOBGSA-N
MW142.25 g/mol
LogP2.11
Rot. Bonds5

About N-[(E)-hexylideneamino]-N-methylmethanamine

N-[(E)-hexylideneamino]-N-methylmethanamine (PubChem CID 11309573) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is N-[(E)-hexylideneamino]-N-methylmethanamine.

Molecular Properties

Compound NameN-[(E)-hexylideneamino]-N-methylmethanamine
PubChem CID11309573
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC NameN-[(E)-hexylideneamino]-N-methylmethanamine
SMILESCCCCC/C=N/N(C)C
InChIInChI=1S/C8H18N2/c1-4-5-6-7-8-9-10(2)3/h8H,4-7H2,1-3H3/b9-8+
InChIKeyKEQDBBYEWHFSRW-CMDGGOBGSA-N
XLogP2.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-[(E)-hexylideneamino]-N-methylmethanamine?
The IUPAC name of N-[(E)-hexylideneamino]-N-methylmethanamine (CID 11309573) is N-[(E)-hexylideneamino]-N-methylmethanamine.
What is the SMILES notation for N-[(E)-hexylideneamino]-N-methylmethanamine?
The canonical SMILES for N-[(E)-hexylideneamino]-N-methylmethanamine is CCCCC/C=N/N(C)C.
What is the InChIKey of N-[(E)-hexylideneamino]-N-methylmethanamine?
The InChIKey is KEQDBBYEWHFSRW-CMDGGOBGSA-N. The full InChI is InChI=1S/C8H18N2/c1-4-5-6-7-8-9-10(2)3/h8H,4-7H2,1-3H3/b9-8+.
What are the key properties of N-[(E)-hexylideneamino]-N-methylmethanamine?
N-[(E)-hexylideneamino]-N-methylmethanamine has a molecular weight of 142.25 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-hexylideneamino]-N-methylmethanamine is sourced from PubChem (CID 11309573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).