3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide

C16H24N2O2 — CID 65167560

IUPAC3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide
SMILESCCOC1CC(Nc2cccc(C(N)=O)c2)C1(C)CC
InChIInChI=1S/C16H24N2O2/c1-4-16(3)13(10-14(16)20-5-2)18-12-8-6-7-11(9-12)15(17)19/h6-9,13-14,18H,4-5,10H2,1-3H3,(H2,17,19)
InChIKeyZFVPDIRJLZMQKH-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.79
Rot. Bonds6

About 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide

3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide (PubChem CID 65167560) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide.

Molecular Properties

Compound Name3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide
PubChem CID65167560
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide
SMILESCCOC1CC(Nc2cccc(C(N)=O)c2)C1(C)CC
InChIInChI=1S/C16H24N2O2/c1-4-16(3)13(10-14(16)20-5-2)18-12-8-6-7-11(9-12)15(17)19/h6-9,13-14,18H,4-5,10H2,1-3H3,(H2,17,19)
InChIKeyZFVPDIRJLZMQKH-UHFFFAOYSA-N
XLogP2.79
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]-3-methylbenzamide
CID 65167864
1-N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-3-N,3-N-dimethylbenzene-1,3-diamine
CID 115376095
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-3-ethynylaniline
CID 65170013
3-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]benzoic acid
CID 65295482
[3-[[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]methyl]phenyl]methanol
CID 107229736
2,6-dichloro-N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)aniline
CID 65467782
2,6-dichloro-4-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]phenol
CID 107679223
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-4-methylsulfanylaniline
CID 65170411
3-[(4,4-dimethylthian-3-yl)amino]benzamide
CID 79952112
2-chloro-4-[(3-ethoxy-2,2-dimethylcyclobutyl)amino]benzamide
CID 64850745
3-N-(3-ethoxy-2,2-dimethylcyclobutyl)-3-N-methylbenzene-1,3-dicarboxamide
CID 119137843
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-6-fluoropyridin-2-amine
CID 116812956

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide?
The IUPAC name of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide (CID 65167560) is 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide.
What is the SMILES notation for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide?
The canonical SMILES for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide is CCOC1CC(Nc2cccc(C(N)=O)c2)C1(C)CC.
What is the InChIKey of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide?
The InChIKey is ZFVPDIRJLZMQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-4-16(3)13(10-14(16)20-5-2)18-12-8-6-7-11(9-12)15(17)19/h6-9,13-14,18H,4-5,10H2,1-3H3,(H2,17,19).
What are the key properties of 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide?
3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide has a molecular weight of 276.38 g/mol, XLogP of 2.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethoxy-2-ethyl-2-methylcyclobutyl)amino]benzamide is sourced from PubChem (CID 65167560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).