N'-benzyl-N,N-dimethylmethanimidamide

C10H14N2 — CID 523875

IUPACN'-benzyl-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/Cc1ccccc1
InChIInChI=1S/C10H14N2/c1-12(2)9-11-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b11-9+
InChIKeyMDCPTIJLAHIMEY-PKNBQFBNSA-N
MW162.24 g/mol
LogP1.78
Rot. Bonds3

About N'-benzyl-N,N-dimethylmethanimidamide

N'-benzyl-N,N-dimethylmethanimidamide (PubChem CID 523875) has the molecular formula C10H14N2 and a molecular weight of 162.24 g/mol. Its IUPAC name is N'-benzyl-N,N-dimethylmethanimidamide.

Molecular Properties

Compound NameN'-benzyl-N,N-dimethylmethanimidamide
PubChem CID523875
Molecular FormulaC10H14N2
Molecular Weight162.24 g/mol
Exact Mass162.12
IUPAC NameN'-benzyl-N,N-dimethylmethanimidamide
SMILESCN(C)/C=N/Cc1ccccc1
InChIInChI=1S/C10H14N2/c1-12(2)9-11-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b11-9+
InChIKeyMDCPTIJLAHIMEY-PKNBQFBNSA-N
XLogP1.78
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.24
LogP ≤ 51.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-benzyl-1-(2-methylphenyl)methanimine;ethane
CID 143782253
(Z)-N-benzylbut-2-en-1-imine
CID 141334721
(2S)-N-benzyl-2-chloropropan-1-imine
CID 131243971
N-benzyl-3-methylbutan-1-imine
CID 11457986
N,N-dimethyl-3-phenylprop-1-en-1-amine
CID 56975797
benzyliminotungsten
CID 21354480
N-benzylpent-2-en-1-imine
CID 71349655
2-benzyliminoacetonitrile
CID 10975606
N-benzyl-1-(6-methyl-2-pyridinyl)methanimine
CID 71333948
4-(4-benzyliminobutyl)-N,N-dimethylaniline
CID 71281782
N'-benzyl-N,N-dimethylethanimidamide
CID 525276
N'-[N'-benzyl-N-[(2,6-dichlorophenyl)methylideneamino]carbamimidoyl]-N,N-dimethylmethanimidamide
CID 70616101

Frequently Asked Questions

What is the IUPAC name of N'-benzyl-N,N-dimethylmethanimidamide?
The IUPAC name of N'-benzyl-N,N-dimethylmethanimidamide (CID 523875) is N'-benzyl-N,N-dimethylmethanimidamide.
What is the SMILES notation for N'-benzyl-N,N-dimethylmethanimidamide?
The canonical SMILES for N'-benzyl-N,N-dimethylmethanimidamide is CN(C)/C=N/Cc1ccccc1.
What is the InChIKey of N'-benzyl-N,N-dimethylmethanimidamide?
The InChIKey is MDCPTIJLAHIMEY-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H14N2/c1-12(2)9-11-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3/b11-9+.
What are the key properties of N'-benzyl-N,N-dimethylmethanimidamide?
N'-benzyl-N,N-dimethylmethanimidamide has a molecular weight of 162.24 g/mol, XLogP of 1.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-benzyl-N,N-dimethylmethanimidamide is sourced from PubChem (CID 523875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).