1-ethyl-N-pentan-3-ylcyclobutan-1-amine

C11H23N — CID 115920874

IUPAC1-ethyl-N-pentan-3-ylcyclobutan-1-amine
SMILESCCC(CC)NC1(CC)CCC1
InChIInChI=1S/C11H23N/c1-4-10(5-2)12-11(6-3)8-7-9-11/h10,12H,4-9H2,1-3H3
InChIKeyFOZKBQNVBDTBSW-UHFFFAOYSA-N
MW169.31 g/mol
LogP3.10
Rot. Bonds5

About 1-ethyl-N-pentan-3-ylcyclobutan-1-amine

1-ethyl-N-pentan-3-ylcyclobutan-1-amine (PubChem CID 115920874) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 1-ethyl-N-pentan-3-ylcyclobutan-1-amine.

Molecular Properties

Compound Name1-ethyl-N-pentan-3-ylcyclobutan-1-amine
PubChem CID115920874
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name1-ethyl-N-pentan-3-ylcyclobutan-1-amine
SMILESCCC(CC)NC1(CC)CCC1
InChIInChI=1S/C11H23N/c1-4-10(5-2)12-11(6-3)8-7-9-11/h10,12H,4-9H2,1-3H3
InChIKeyFOZKBQNVBDTBSW-UHFFFAOYSA-N
XLogP3.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-pentan-3-ylcyclobutan-1-amine?
The IUPAC name of 1-ethyl-N-pentan-3-ylcyclobutan-1-amine (CID 115920874) is 1-ethyl-N-pentan-3-ylcyclobutan-1-amine.
What is the SMILES notation for 1-ethyl-N-pentan-3-ylcyclobutan-1-amine?
The canonical SMILES for 1-ethyl-N-pentan-3-ylcyclobutan-1-amine is CCC(CC)NC1(CC)CCC1.
What is the InChIKey of 1-ethyl-N-pentan-3-ylcyclobutan-1-amine?
The InChIKey is FOZKBQNVBDTBSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-4-10(5-2)12-11(6-3)8-7-9-11/h10,12H,4-9H2,1-3H3.
What are the key properties of 1-ethyl-N-pentan-3-ylcyclobutan-1-amine?
1-ethyl-N-pentan-3-ylcyclobutan-1-amine has a molecular weight of 169.31 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-pentan-3-ylcyclobutan-1-amine is sourced from PubChem (CID 115920874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).