N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide

C14H20Cl2N2O3 — CID 111860122

IUPACN-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide
SMILESCOCC(C)(CCO)NCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H20Cl2N2O3/c1-14(6-7-19,9-21-2)17-8-12(20)18-13-10(15)4-3-5-11(13)16/h3-5,17,19H,6-9H2,1-2H3,(H,18,20)
InChIKeyITCXZNQTNFVAJQ-UHFFFAOYSA-N
MW335.23 g/mol
LogP2.31
Rot. Bonds8

About N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide

N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide (PubChem CID 111860122) has the molecular formula C14H20Cl2N2O3 and a molecular weight of 335.23 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide
PubChem CID111860122
Molecular FormulaC14H20Cl2N2O3
Molecular Weight335.23 g/mol
Exact Mass334.09
IUPAC NameN-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide
SMILESCOCC(C)(CCO)NCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H20Cl2N2O3/c1-14(6-7-19,9-21-2)17-8-12(20)18-13-10(15)4-3-5-11(13)16/h3-5,17,19H,6-9H2,1-2H3,(H,18,20)
InChIKeyITCXZNQTNFVAJQ-UHFFFAOYSA-N
XLogP2.31
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.23
LogP ≤ 52.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]-2-methylbutanoic acid
CID 79801477
methyl N-[2-(2,6-dichloroanilino)-2-oxoethyl]carbamate
CID 113001448
N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159615
N-(2,6-dichlorophenyl)-2-(3-hydroxypropylamino)acetamide
CID 43405278
N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide
CID 39445182
N-(2,6-dichlorophenyl)-2-(3-methoxyanilino)acetamide
CID 43405262
methyl 2-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]benzoate
CID 109010077
2-chloro-3-fluoro-N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)benzamide
CID 110002736
2-[2-(2-chloro-4-fluorophenyl)propan-2-ylamino]-N-(2,6-dichlorophenyl)acetamide
CID 86949913
N,N'-bis(2,6-dichlorophenyl)butanediamide
CID 1010966
4-tert-butyl-N-[2-(2,6-dichloroanilino)-2-oxoethyl]benzamide
CID 113001418
1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]ethanone
CID 111860110

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide (CID 111860122) is N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide is COCC(C)(CCO)NCC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide?
The InChIKey is ITCXZNQTNFVAJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O3/c1-14(6-7-19,9-21-2)17-8-12(20)18-13-10(15)4-3-5-11(13)16/h3-5,17,19H,6-9H2,1-2H3,(H,18,20).
What are the key properties of N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide?
N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide has a molecular weight of 335.23 g/mol, XLogP of 2.31, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxy-2-methylbutan-2-yl)amino]acetamide is sourced from PubChem (CID 111860122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).