N-imino-4,4-dimethylpentanamide

C7H14N2O — CID 118964364

IUPACN-imino-4,4-dimethylpentanamide
SMILES[H]/N=N/C(=O)CCC(C)(C)C
InChIInChI=1S/C7H14N2O/c1-7(2,3)5-4-6(10)9-8/h8H,4-5H2,1-3H3/b9-8+
InChIKeyWMNBALGIKPVBSN-CMDGGOBGSA-N
MW142.20 g/mol
LogP2.37
Rot. Bonds2

About N-imino-4,4-dimethylpentanamide

N-imino-4,4-dimethylpentanamide (PubChem CID 118964364) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is N-imino-4,4-dimethylpentanamide.

Molecular Properties

Compound NameN-imino-4,4-dimethylpentanamide
PubChem CID118964364
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC NameN-imino-4,4-dimethylpentanamide
SMILES[H]/N=N/C(=O)CCC(C)(C)C
InChIInChI=1S/C7H14N2O/c1-7(2,3)5-4-6(10)9-8/h8H,4-5H2,1-3H3/b9-8+
InChIKeyWMNBALGIKPVBSN-CMDGGOBGSA-N
XLogP2.37
TPSA53.28 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

2,2,8,8-tetramethylnonan-5-imine
CID 158057616
2,2,6,6-tetramethylheptan-3-imine
CID 134551035
4,4-dimethylpentanamide;hydrochloride
CID 141202343
N'-amino-N-imino-2,2,6-trimethyl-5-oxoheptanimidamide;ethane
CID 142311021
4,4-dimethyl-1-trimethylsilylpentan-1-one
CID 13161103
methane;2,2,7,7-tetramethyloctan-4-one
CID 160856578
2-(dimethylamino)-2,6,6-trimethylheptan-3-one
CID 79047134
2-[(dimethylamino)methyl]-N,N'-diiminobutanediamide
CID 175431476
2,7,7-trimethyloctan-4-one
CID 62619842
acetyl 4,4-dimethylpentanoate
CID 141030894
5,5-dimethyl-2-methylidenehexanamide
CID 118453407
2-methoxy-2,6,6-trimethylheptan-3-one
CID 79196927

Frequently Asked Questions

What is the IUPAC name of N-imino-4,4-dimethylpentanamide?
The IUPAC name of N-imino-4,4-dimethylpentanamide (CID 118964364) is N-imino-4,4-dimethylpentanamide.
What is the SMILES notation for N-imino-4,4-dimethylpentanamide?
The canonical SMILES for N-imino-4,4-dimethylpentanamide is [H]/N=N/C(=O)CCC(C)(C)C.
What is the InChIKey of N-imino-4,4-dimethylpentanamide?
The InChIKey is WMNBALGIKPVBSN-CMDGGOBGSA-N. The full InChI is InChI=1S/C7H14N2O/c1-7(2,3)5-4-6(10)9-8/h8H,4-5H2,1-3H3/b9-8+.
What are the key properties of N-imino-4,4-dimethylpentanamide?
N-imino-4,4-dimethylpentanamide has a molecular weight of 142.20 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-imino-4,4-dimethylpentanamide is sourced from PubChem (CID 118964364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).