N,N-dibutyl-N'-methylethanimidamide

C11H24N2 — CID 13042442

IUPACN,N-dibutyl-N'-methylethanimidamide
SMILESCCCCN(CCCC)/C(C)=N/C
InChIInChI=1S/C11H24N2/c1-5-7-9-13(10-8-6-2)11(3)12-4/h5-10H2,1-4H3/b12-11+
InChIKeyOEYSCFYKEIEBPP-VAWYXSNFSA-N
MW184.33 g/mol
LogP2.94
Rot. Bonds6

About N,N-dibutyl-N'-methylethanimidamide

N,N-dibutyl-N'-methylethanimidamide (PubChem CID 13042442) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N,N-dibutyl-N'-methylethanimidamide.

Molecular Properties

Compound NameN,N-dibutyl-N'-methylethanimidamide
PubChem CID13042442
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN,N-dibutyl-N'-methylethanimidamide
SMILESCCCCN(CCCC)/C(C)=N/C
InChIInChI=1S/C11H24N2/c1-5-7-9-13(10-8-6-2)11(3)12-4/h5-10H2,1-4H3/b12-11+
InChIKeyOEYSCFYKEIEBPP-VAWYXSNFSA-N
XLogP2.94
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.94
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'}

Analyze N,N-dibutyl-N'-methylethanimidamide 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,N-dibutyl-N'-methylethanimidamide?
The IUPAC name of N,N-dibutyl-N'-methylethanimidamide (CID 13042442) is N,N-dibutyl-N'-methylethanimidamide.
What is the SMILES notation for N,N-dibutyl-N'-methylethanimidamide?
The canonical SMILES for N,N-dibutyl-N'-methylethanimidamide is CCCCN(CCCC)/C(C)=N/C.
What is the InChIKey of N,N-dibutyl-N'-methylethanimidamide?
The InChIKey is OEYSCFYKEIEBPP-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-7-9-13(10-8-6-2)11(3)12-4/h5-10H2,1-4H3/b12-11+.
What are the key properties of N,N-dibutyl-N'-methylethanimidamide?
N,N-dibutyl-N'-methylethanimidamide has a molecular weight of 184.33 g/mol, XLogP of 2.94, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-N'-methylethanimidamide is sourced from PubChem (CID 13042442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).