N-ethyl-2,2-dimethylpropan-1-amine

C7H17N — CID 14525026

IUPACN-ethyl-2,2-dimethylpropan-1-amine
SMILESCCNCC(C)(C)C
InChIInChI=1S/C7H17N/c1-5-8-6-7(2,3)4/h8H,5-6H2,1-4H3
InChIKeyWHXPIXBWEZSBJL-UHFFFAOYSA-N
MW115.22 g/mol
LogP1.64
Rot. Bonds2

About N-ethyl-2,2-dimethylpropan-1-amine

N-ethyl-2,2-dimethylpropan-1-amine (PubChem CID 14525026) has the molecular formula C7H17N and a molecular weight of 115.22 g/mol. Its IUPAC name is N-ethyl-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethylpropan-1-amine
PubChem CID14525026
Molecular FormulaC7H17N
Molecular Weight115.22 g/mol
Exact Mass115.14
IUPAC NameN-ethyl-2,2-dimethylpropan-1-amine
SMILESCCNCC(C)(C)C
InChIInChI=1S/C7H17N/c1-5-8-6-7(2,3)4/h8H,5-6H2,1-4H3
InChIKeyWHXPIXBWEZSBJL-UHFFFAOYSA-N
XLogP1.64
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.22
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethylpropan-1-amine?
The IUPAC name of N-ethyl-2,2-dimethylpropan-1-amine (CID 14525026) is N-ethyl-2,2-dimethylpropan-1-amine.
What is the SMILES notation for N-ethyl-2,2-dimethylpropan-1-amine?
The canonical SMILES for N-ethyl-2,2-dimethylpropan-1-amine is CCNCC(C)(C)C.
What is the InChIKey of N-ethyl-2,2-dimethylpropan-1-amine?
The InChIKey is WHXPIXBWEZSBJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N/c1-5-8-6-7(2,3)4/h8H,5-6H2,1-4H3.
What are the key properties of N-ethyl-2,2-dimethylpropan-1-amine?
N-ethyl-2,2-dimethylpropan-1-amine has a molecular weight of 115.22 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 14525026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).