N-ethyl-N,3,3-trimethylcyclobutan-1-amine

C9H19N — CID 167253957

IUPACN-ethyl-N,3,3-trimethylcyclobutan-1-amine
SMILESCCN(C)C1CC(C)(C)C1
InChIInChI=1S/C9H19N/c1-5-10(4)8-6-9(2,3)7-8/h8H,5-7H2,1-4H3
InChIKeyVJBFDRFUGKKBCG-UHFFFAOYSA-N
MW141.26 g/mol
LogP2.13
Rot. Bonds2

About N-ethyl-N,3,3-trimethylcyclobutan-1-amine

N-ethyl-N,3,3-trimethylcyclobutan-1-amine (PubChem CID 167253957) has the molecular formula C9H19N and a molecular weight of 141.26 g/mol. Its IUPAC name is N-ethyl-N,3,3-trimethylcyclobutan-1-amine.

Molecular Properties

Compound NameN-ethyl-N,3,3-trimethylcyclobutan-1-amine
PubChem CID167253957
Molecular FormulaC9H19N
Molecular Weight141.26 g/mol
Exact Mass141.15
IUPAC NameN-ethyl-N,3,3-trimethylcyclobutan-1-amine
SMILESCCN(C)C1CC(C)(C)C1
InChIInChI=1S/C9H19N/c1-5-10(4)8-6-9(2,3)7-8/h8H,5-7H2,1-4H3
InChIKeyVJBFDRFUGKKBCG-UHFFFAOYSA-N
XLogP2.13
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.26
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N,3,3-trimethylcyclobutan-1-amine?
The IUPAC name of N-ethyl-N,3,3-trimethylcyclobutan-1-amine (CID 167253957) is N-ethyl-N,3,3-trimethylcyclobutan-1-amine.
What is the SMILES notation for N-ethyl-N,3,3-trimethylcyclobutan-1-amine?
The canonical SMILES for N-ethyl-N,3,3-trimethylcyclobutan-1-amine is CCN(C)C1CC(C)(C)C1.
What is the InChIKey of N-ethyl-N,3,3-trimethylcyclobutan-1-amine?
The InChIKey is VJBFDRFUGKKBCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N/c1-5-10(4)8-6-9(2,3)7-8/h8H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N,3,3-trimethylcyclobutan-1-amine?
N-ethyl-N,3,3-trimethylcyclobutan-1-amine has a molecular weight of 141.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N,3,3-trimethylcyclobutan-1-amine is sourced from PubChem (CID 167253957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).