2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide

C17H32N2O2 — CID 103161315

IUPAC2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide
SMILESCCNC1CCC(N(C)C(=O)CC2CC(OCC)C2)CC1
InChIInChI=1S/C17H32N2O2/c1-4-18-14-6-8-15(9-7-14)19(3)17(20)12-13-10-16(11-13)21-5-2/h13-16,18H,4-12H2,1-3H3
InChIKeyGJHNBZCRBPRGDW-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.57
Rot. Bonds7

About 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide

2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide (PubChem CID 103161315) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide
PubChem CID103161315
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC Name2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide
SMILESCCNC1CCC(N(C)C(=O)CC2CC(OCC)C2)CC1
InChIInChI=1S/C17H32N2O2/c1-4-18-14-6-8-15(9-7-14)19(3)17(20)12-13-10-16(11-13)21-5-2/h13-16,18H,4-12H2,1-3H3
InChIKeyGJHNBZCRBPRGDW-UHFFFAOYSA-N
XLogP2.57
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide?
The IUPAC name of 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide (CID 103161315) is 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide is CCNC1CCC(N(C)C(=O)CC2CC(OCC)C2)CC1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide?
The InChIKey is GJHNBZCRBPRGDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-4-18-14-6-8-15(9-7-14)19(3)17(20)12-13-10-16(11-13)21-5-2/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide?
2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide has a molecular weight of 296.45 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-N-[4-(ethylamino)cyclohexyl]-N-methylacetamide is sourced from PubChem (CID 103161315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).