N-[(Z)-hexylideneamino]-N-methylformamide

C8H16N2O — CID 5367942

IUPACN-[(Z)-hexylideneamino]-N-methylformamide
SMILESCCCCC/C=N\N(C)C=O
InChIInChI=1S/C8H16N2O/c1-3-4-5-6-7-9-10(2)8-11/h7-8H,3-6H2,1-2H3/b9-7-
InChIKeyQRMNFHXPNKCTAG-CLFYSBASSA-N
MW156.23 g/mol
LogP1.64
Rot. Bonds6

About N-[(Z)-hexylideneamino]-N-methylformamide

N-[(Z)-hexylideneamino]-N-methylformamide (PubChem CID 5367942) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-[(Z)-hexylideneamino]-N-methylformamide.

Molecular Properties

Compound NameN-[(Z)-hexylideneamino]-N-methylformamide
PubChem CID5367942
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-[(Z)-hexylideneamino]-N-methylformamide
SMILESCCCCC/C=N\N(C)C=O
InChIInChI=1S/C8H16N2O/c1-3-4-5-6-7-9-10(2)8-11/h7-8H,3-6H2,1-2H3/b9-7-
InChIKeyQRMNFHXPNKCTAG-CLFYSBASSA-N
XLogP1.64
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-[(Z)-hexylideneamino]-N-methylformamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-hexylideneamino]-N-methylformamide?
The IUPAC name of N-[(Z)-hexylideneamino]-N-methylformamide (CID 5367942) is N-[(Z)-hexylideneamino]-N-methylformamide.
What is the SMILES notation for N-[(Z)-hexylideneamino]-N-methylformamide?
The canonical SMILES for N-[(Z)-hexylideneamino]-N-methylformamide is CCCCC/C=N\N(C)C=O.
What is the InChIKey of N-[(Z)-hexylideneamino]-N-methylformamide?
The InChIKey is QRMNFHXPNKCTAG-CLFYSBASSA-N. The full InChI is InChI=1S/C8H16N2O/c1-3-4-5-6-7-9-10(2)8-11/h7-8H,3-6H2,1-2H3/b9-7-.
What are the key properties of N-[(Z)-hexylideneamino]-N-methylformamide?
N-[(Z)-hexylideneamino]-N-methylformamide has a molecular weight of 156.23 g/mol, XLogP of 1.64, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-hexylideneamino]-N-methylformamide is sourced from PubChem (CID 5367942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).