N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide

C15H28N2O2 — CID 66194926

IUPACN-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide
SMILESCCOC1CC(N)C1NC(=O)C1CCCCCCC1
InChIInChI=1S/C15H28N2O2/c1-2-19-13-10-12(16)14(13)17-15(18)11-8-6-4-3-5-7-9-11/h11-14H,2-10,16H2,1H3,(H,17,18)
InChIKeyXDBBSQQNHZQAMD-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.97
Rot. Bonds4

About N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide

N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide (PubChem CID 66194926) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide.

Molecular Properties

Compound NameN-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide
PubChem CID66194926
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC NameN-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide
SMILESCCOC1CC(N)C1NC(=O)C1CCCCCCC1
InChIInChI=1S/C15H28N2O2/c1-2-19-13-10-12(16)14(13)17-15(18)11-8-6-4-3-5-7-9-11/h11-14H,2-10,16H2,1H3,(H,17,18)
InChIKeyXDBBSQQNHZQAMD-UHFFFAOYSA-N
XLogP1.97
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide?
The IUPAC name of N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide (CID 66194926) is N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide.
What is the SMILES notation for N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide?
The canonical SMILES for N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide is CCOC1CC(N)C1NC(=O)C1CCCCCCC1.
What is the InChIKey of N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide?
The InChIKey is XDBBSQQNHZQAMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-2-19-13-10-12(16)14(13)17-15(18)11-8-6-4-3-5-7-9-11/h11-14H,2-10,16H2,1H3,(H,17,18).
What are the key properties of N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide?
N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-ethoxycyclobutyl)cyclooctanecarboxamide is sourced from PubChem (CID 66194926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).