N-methyl-5-methyliminohexanamide

C8H16N2O — CID 146580265

IUPACN-methyl-5-methyliminohexanamide
SMILESC/N=C(\C)CCCC(=O)NC
InChIInChI=1S/C8H16N2O/c1-7(9-2)5-4-6-8(11)10-3/h4-6H2,1-3H3,(H,10,11)/b9-7+
InChIKeyZRMOWUFHLJWMQQ-VQHVLOKHSA-N
MW156.23 g/mol
LogP0.99
Rot. Bonds4

About N-methyl-5-methyliminohexanamide

N-methyl-5-methyliminohexanamide (PubChem CID 146580265) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is N-methyl-5-methyliminohexanamide.

Molecular Properties

Compound NameN-methyl-5-methyliminohexanamide
PubChem CID146580265
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC NameN-methyl-5-methyliminohexanamide
SMILESC/N=C(\C)CCCC(=O)NC
InChIInChI=1S/C8H16N2O/c1-7(9-2)5-4-6-8(11)10-3/h4-6H2,1-3H3,(H,10,11)/b9-7+
InChIKeyZRMOWUFHLJWMQQ-VQHVLOKHSA-N
XLogP0.99
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-5-methyliminohexanamide?
The IUPAC name of N-methyl-5-methyliminohexanamide (CID 146580265) is N-methyl-5-methyliminohexanamide.
What is the SMILES notation for N-methyl-5-methyliminohexanamide?
The canonical SMILES for N-methyl-5-methyliminohexanamide is C/N=C(\C)CCCC(=O)NC.
What is the InChIKey of N-methyl-5-methyliminohexanamide?
The InChIKey is ZRMOWUFHLJWMQQ-VQHVLOKHSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7(9-2)5-4-6-8(11)10-3/h4-6H2,1-3H3,(H,10,11)/b9-7+.
What are the key properties of N-methyl-5-methyliminohexanamide?
N-methyl-5-methyliminohexanamide has a molecular weight of 156.23 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-methyliminohexanamide is sourced from PubChem (CID 146580265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).