N'-butyl-N,N,2,2-tetramethylpropanimidamide

C11H24N2 — CID 525897

IUPACN'-butyl-N,N,2,2-tetramethylpropanimidamide
SMILESCCCC/N=C(\N(C)C)C(C)(C)C
InChIInChI=1S/C11H24N2/c1-7-8-9-12-10(13(5)6)11(2,3)4/h7-9H2,1-6H3/b12-10-
InChIKeyMGCRSFQHTYPADF-BENRWUELSA-N
MW184.33 g/mol
LogP2.79
Rot. Bonds3

About N'-butyl-N,N,2,2-tetramethylpropanimidamide

N'-butyl-N,N,2,2-tetramethylpropanimidamide (PubChem CID 525897) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N'-butyl-N,N,2,2-tetramethylpropanimidamide.

Molecular Properties

Compound NameN'-butyl-N,N,2,2-tetramethylpropanimidamide
PubChem CID525897
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN'-butyl-N,N,2,2-tetramethylpropanimidamide
SMILESCCCC/N=C(\N(C)C)C(C)(C)C
InChIInChI=1S/C11H24N2/c1-7-8-9-12-10(13(5)6)11(2,3)4/h7-9H2,1-6H3/b12-10-
InChIKeyMGCRSFQHTYPADF-BENRWUELSA-N
XLogP2.79
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N'-Butyl-N,N-dimethyl-acetamidine
CID 525277
N,N-Dimethyl-N'-propyl-isobutyramidine
CID 525846
N,N-dimethyl-N'-propylpropanimidamide
CID 22211913
N,N-Dimethyl-N'-butyl-propionamidine
CID 525837
N,N-Dimethyl-N'-pentyl-propionamidine
CID 525844
N,N-Dimethyl-N'-butyl-isobutyramidine
CID 525896
N,N-Dimethyl-N'-heptyl-pivalamidine
CID 525903
N,N-Dimethyl-N'-hexyl-pivalamidine
CID 525905
N,N-Dimethyl-N'-pentyl-isobutyramidine
CID 525910
N,N-Dimethyl-N'-pentyl-pivalamidine
CID 525911
N,N-Dimethyl-N'-propyl-pivalamidine
CID 525914
N,N,N'-trimethylbutanimidamide
CID 13042447

Frequently Asked Questions

What is the IUPAC name of N'-butyl-N,N,2,2-tetramethylpropanimidamide?
The IUPAC name of N'-butyl-N,N,2,2-tetramethylpropanimidamide (CID 525897) is N'-butyl-N,N,2,2-tetramethylpropanimidamide.
What is the SMILES notation for N'-butyl-N,N,2,2-tetramethylpropanimidamide?
The canonical SMILES for N'-butyl-N,N,2,2-tetramethylpropanimidamide is CCCC/N=C(\N(C)C)C(C)(C)C.
What is the InChIKey of N'-butyl-N,N,2,2-tetramethylpropanimidamide?
The InChIKey is MGCRSFQHTYPADF-BENRWUELSA-N. The full InChI is InChI=1S/C11H24N2/c1-7-8-9-12-10(13(5)6)11(2,3)4/h7-9H2,1-6H3/b12-10-.
What are the key properties of N'-butyl-N,N,2,2-tetramethylpropanimidamide?
N'-butyl-N,N,2,2-tetramethylpropanimidamide has a molecular weight of 184.33 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butyl-N,N,2,2-tetramethylpropanimidamide is sourced from PubChem (CID 525897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).