N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide

C14H20N2O3 — CID 115869842

IUPACN-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide
SMILESCC(C)(CCO)NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-14(2,8-9-17)16-12(18)10-15-13(19)11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyYNLDDFNBRSQRKM-UHFFFAOYSA-N
MW264.32 g/mol
LogP0.69
Rot. Bonds6

About N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide

N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide (PubChem CID 115869842) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide.

Molecular Properties

Compound NameN-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide
PubChem CID115869842
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide
SMILESCC(C)(CCO)NC(=O)CNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O3/c1-14(2,8-9-17)16-12(18)10-15-13(19)11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3,(H,15,19)(H,16,18)
InChIKeyYNLDDFNBRSQRKM-UHFFFAOYSA-N
XLogP0.69
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 50.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-benzamidoacetyl)amino]-2-methylpropanoic acid
CID 61262989
N-[2-[3-(hydroxymethyl)pentan-3-ylamino]-2-oxoethyl]benzamide
CID 62520110
N-[2-[(1-hydroxy-4,4-dimethylpentan-3-yl)amino]-2-oxoethyl]benzamide
CID 103941024
2-acetamido-N-(4-hydroxy-2-methylbutan-2-yl)acetamide
CID 115968810
N-[3-[(1-hydroxy-2-methylpropan-2-yl)amino]-3-oxopropyl]benzamide
CID 43391483
N-(4-hydroxy-2-methylbutan-2-yl)-3-phenylpropanamide
CID 115870187
4-amino-N-[2-[(4-amino-2-methyl-4-oxobutan-2-yl)amino]-2-oxoethyl]benzamide
CID 106096432
4-cyano-N-[2-(2-methylpentan-2-ylamino)-2-oxoethyl]benzamide
CID 86816052
4-amino-N-[2-[(1-hydroxy-3-methylpentan-3-yl)amino]-2-oxoethyl]benzamide
CID 106176497
4-tert-butyl-N-(4-hydroxy-2-methylbutan-2-yl)benzamide
CID 115870121
ethyl 2-[(2-benzamidoacetyl)amino]-2-tert-butylsulfanylpropanoate
CID 90111327
N-[4-[(1-hydroxy-2-methylpropan-2-yl)amino]-4-oxobutan-2-yl]benzamide
CID 110000733

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide?
The IUPAC name of N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide (CID 115869842) is N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide.
What is the SMILES notation for N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide?
The canonical SMILES for N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide is CC(C)(CCO)NC(=O)CNC(=O)c1ccccc1.
What is the InChIKey of N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide?
The InChIKey is YNLDDFNBRSQRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-14(2,8-9-17)16-12(18)10-15-13(19)11-6-4-3-5-7-11/h3-7,17H,8-10H2,1-2H3,(H,15,19)(H,16,18).
What are the key properties of N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide?
N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide has a molecular weight of 264.32 g/mol, XLogP of 0.69, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]-2-oxoethyl]benzamide is sourced from PubChem (CID 115869842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).