N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide

C15H20N2O3 — CID 102684785

IUPACN-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
SMILESO=C(NCC(=O)N(CCO)C1CCC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c18-10-9-17(13-7-4-8-13)14(19)11-16-15(20)12-5-2-1-3-6-12/h1-3,5-6,13,18H,4,7-11H2,(H,16,20)
InChIKeyLQFFZELQBAEDIF-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.79
Rot. Bonds6

About N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide

N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide (PubChem CID 102684785) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
PubChem CID102684785
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC NameN-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide
SMILESO=C(NCC(=O)N(CCO)C1CCC1)c1ccccc1
InChIInChI=1S/C15H20N2O3/c18-10-9-17(13-7-4-8-13)14(19)11-16-15(20)12-5-2-1-3-6-12/h1-3,5-6,13,18H,4,7-11H2,(H,16,20)
InChIKeyLQFFZELQBAEDIF-UHFFFAOYSA-N
XLogP0.79
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[cyclopropyl(2-hydroxyethyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 43577077
N-[2-[2-hydroxyethyl(propyl)amino]-2-oxoethyl]benzamide
CID 60656778
N-[2-[methyl(piperidin-3-yl)amino]-2-oxoethyl]benzamide
CID 60807055
N-[2-[azetidin-3-yl(methyl)amino]-2-oxoethyl]benzamide
CID 66185921
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 102684381
[2-(dicyclohexylamino)-2-oxoethyl] 2-benzamidoacetate
CID 3593681
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
2-[[2-[(3-chlorobenzoyl)amino]acetyl]-cyclopropylamino]acetic acid
CID 60827367
N-cyclobutyl-N-(2-hydroxyethyl)-1-phenyltriazole-4-carboxamide
CID 102684340
N-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]benzamide
CID 110757185
N-cyclopentyl-N-(2-hydroxyethyl)pyridine-2-carboxamide
CID 54994544
N-cyclopentyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
CID 54994210

Frequently Asked Questions

What is the IUPAC name of N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide (CID 102684785) is N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide is O=C(NCC(=O)N(CCO)C1CCC1)c1ccccc1.
What is the InChIKey of N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
The InChIKey is LQFFZELQBAEDIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c18-10-9-17(13-7-4-8-13)14(19)11-16-15(20)12-5-2-1-3-6-12/h1-3,5-6,13,18H,4,7-11H2,(H,16,20).
What are the key properties of N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide?
N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide has a molecular weight of 276.34 g/mol, XLogP of 0.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[cyclobutyl(2-hydroxyethyl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 102684785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).