N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide

C17H24N2O3 — CID 71985976

IUPACN-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide
SMILESCOC1(C)CC(NC(=O)CNC(=O)c2ccccc2)C1(C)C
InChIInChI=1S/C17H24N2O3/c1-16(2)13(10-17(16,3)22-4)19-14(20)11-18-15(21)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,18,21)(H,19,20)
InChIKeyZCUSDDJVHZLCLI-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.74
Rot. Bonds5

About N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide

N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide (PubChem CID 71985976) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide
PubChem CID71985976
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC NameN-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide
SMILESCOC1(C)CC(NC(=O)CNC(=O)c2ccccc2)C1(C)C
InChIInChI=1S/C17H24N2O3/c1-16(2)13(10-17(16,3)22-4)19-14(20)11-18-15(21)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,18,21)(H,19,20)
InChIKeyZCUSDDJVHZLCLI-UHFFFAOYSA-N
XLogP1.74
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

cis-methyl (1S,2R)-1-[(2-benzamidoacetyl)amino]-2-(hydroxymethyl)cyclopropane-1-carboxylate
CID 15342597
4-[(3-methoxy-2,2,3-trimethylcyclobutyl)carbamoyl]pyridine-2-carboxylic acid
CID 119187196
N-[2-(cyclopropylmethylamino)-2-oxoethyl]benzamide
CID 25469630
N-[2-[[(1R,2R,3R)-2,3-dihydroxycyclohexyl]amino]-2-oxoethyl]benzamide
CID 110158776
N-[2-[[1-(2,6-dimethoxybenzoyl)piperidin-4-yl]amino]-2-oxoethyl]benzamide
CID 108550402
1-[(2-benzamidoacetyl)amino]cyclopropane-1-carboxylic acid
CID 65450960
N-[2-[[1-(3-methoxyphenyl)-5-oxopyrrolidin-3-yl]amino]-2-oxoethyl]benzamide
CID 134813179
4-[[(2-benzamidoacetyl)amino]methyl]cyclohexane-1-carboxylate
CID 8022651
N-[2-[[(3aR,4S,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]amino]-2-oxoethyl]benzamide
CID 11891342
N-[2-[[(3aR,4R,6R,6aR)-6-(hydroxymethyl)-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-4-yl]amino]-2-oxoethyl]benzamide
CID 1211911
N-[2-[1-(3,5-dimethylpiperidin-1-yl)propan-2-ylamino]-2-oxoethyl]benzamide
CID 60574406
N-[2-(2,5-dimethoxy-4-methylanilino)-2-oxoethyl]benzamide
CID 110792956

Frequently Asked Questions

What is the IUPAC name of N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide (CID 71985976) is N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide is COC1(C)CC(NC(=O)CNC(=O)c2ccccc2)C1(C)C.
What is the InChIKey of N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide?
The InChIKey is ZCUSDDJVHZLCLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-16(2)13(10-17(16,3)22-4)19-14(20)11-18-15(21)12-8-6-5-7-9-12/h5-9,13H,10-11H2,1-4H3,(H,18,21)(H,19,20).
What are the key properties of N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide?
N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide has a molecular weight of 304.39 g/mol, XLogP of 1.74, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(3-methoxy-2,2,3-trimethylcyclobutyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 71985976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).