N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide

C9H20N2 — CID 59021733

IUPACN'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide
SMILESC/C(=N\CC(C)(C)C)N(C)C
InChIInChI=1S/C9H20N2/c1-8(11(5)6)10-7-9(2,3)4/h7H2,1-6H3/b10-8+
InChIKeyPQGYRDGNDMBFSU-CSKARUKUSA-N
MW156.27 g/mol
LogP2.01
Rot. Bonds1

About N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide

N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide (PubChem CID 59021733) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide.

Molecular Properties

Compound NameN'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide
PubChem CID59021733
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC NameN'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide
SMILESC/C(=N\CC(C)(C)C)N(C)C
InChIInChI=1S/C9H20N2/c1-8(11(5)6)10-7-9(2,3)4/h7H2,1-6H3/b10-8+
InChIKeyPQGYRDGNDMBFSU-CSKARUKUSA-N
XLogP2.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.01
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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Frequently Asked Questions

What is the IUPAC name of N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide?
The IUPAC name of N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide (CID 59021733) is N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide.
What is the SMILES notation for N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide?
The canonical SMILES for N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide is C/C(=N\CC(C)(C)C)N(C)C.
What is the InChIKey of N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide?
The InChIKey is PQGYRDGNDMBFSU-CSKARUKUSA-N. The full InChI is InChI=1S/C9H20N2/c1-8(11(5)6)10-7-9(2,3)4/h7H2,1-6H3/b10-8+.
What are the key properties of N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide?
N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide has a molecular weight of 156.27 g/mol, XLogP of 2.01, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,2-dimethylpropyl)-N,N-dimethylethanimidamide is sourced from PubChem (CID 59021733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).