N,2,2,3-tetramethyl-N-propylbutanimidamide

C11H24N2 — CID 139650373

IUPACN,2,2,3-tetramethyl-N-propylbutanimidamide
SMILES[H]/N=C(\N(C)CCC)C(C)(C)C(C)C
InChIInChI=1S/C11H24N2/c1-7-8-13(6)10(12)11(4,5)9(2)3/h9,12H,7-8H2,1-6H3/b12-10-
InChIKeyZIEZDVMTQOGJTH-BENRWUELSA-N
MW184.33 g/mol
LogP2.99
Rot. Bonds4

About N,2,2,3-tetramethyl-N-propylbutanimidamide

N,2,2,3-tetramethyl-N-propylbutanimidamide (PubChem CID 139650373) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N,2,2,3-tetramethyl-N-propylbutanimidamide.

Molecular Properties

Compound NameN,2,2,3-tetramethyl-N-propylbutanimidamide
PubChem CID139650373
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN,2,2,3-tetramethyl-N-propylbutanimidamide
SMILES[H]/N=C(\N(C)CCC)C(C)(C)C(C)C
InChIInChI=1S/C11H24N2/c1-7-8-13(6)10(12)11(4,5)9(2)3/h9,12H,7-8H2,1-6H3/b12-10-
InChIKeyZIEZDVMTQOGJTH-BENRWUELSA-N
XLogP2.99
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 52.99
H-Bond Donors ≤ 51
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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Frequently Asked Questions

What is the IUPAC name of N,2,2,3-tetramethyl-N-propylbutanimidamide?
The IUPAC name of N,2,2,3-tetramethyl-N-propylbutanimidamide (CID 139650373) is N,2,2,3-tetramethyl-N-propylbutanimidamide.
What is the SMILES notation for N,2,2,3-tetramethyl-N-propylbutanimidamide?
The canonical SMILES for N,2,2,3-tetramethyl-N-propylbutanimidamide is [H]/N=C(\N(C)CCC)C(C)(C)C(C)C.
What is the InChIKey of N,2,2,3-tetramethyl-N-propylbutanimidamide?
The InChIKey is ZIEZDVMTQOGJTH-BENRWUELSA-N. The full InChI is InChI=1S/C11H24N2/c1-7-8-13(6)10(12)11(4,5)9(2)3/h9,12H,7-8H2,1-6H3/b12-10-.
What are the key properties of N,2,2,3-tetramethyl-N-propylbutanimidamide?
N,2,2,3-tetramethyl-N-propylbutanimidamide has a molecular weight of 184.33 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2,3-tetramethyl-N-propylbutanimidamide is sourced from PubChem (CID 139650373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).