N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide

C14H20Cl2N2O2 — CID 106160091

IUPACN-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide
SMILESCC(CO)CCCNCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H20Cl2N2O2/c1-10(9-19)4-3-7-17-8-13(20)18-14-11(15)5-2-6-12(14)16/h2,5-6,10,17,19H,3-4,7-9H2,1H3,(H,18,20)
InChIKeyDORJWXJFFDBNDX-UHFFFAOYSA-N
MW319.23 g/mol
LogP2.93
Rot. Bonds8

About N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide

N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide (PubChem CID 106160091) has the molecular formula C14H20Cl2N2O2 and a molecular weight of 319.23 g/mol. Its IUPAC name is N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide
PubChem CID106160091
Molecular FormulaC14H20Cl2N2O2
Molecular Weight319.23 g/mol
Exact Mass318.09
IUPAC NameN-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide
SMILESCC(CO)CCCNCC(=O)Nc1c(Cl)cccc1Cl
InChIInChI=1S/C14H20Cl2N2O2/c1-10(9-19)4-3-7-17-8-13(20)18-14-11(15)5-2-6-12(14)16/h2,5-6,10,17,19H,3-4,7-9H2,1H3,(H,18,20)
InChIKeyDORJWXJFFDBNDX-UHFFFAOYSA-N
XLogP2.93
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.23
LogP ≤ 52.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-dichlorophenyl)-2-(3-hydroxypropylamino)acetamide
CID 43405278
3-[[2-(2,6-dichloroanilino)-2-oxoethyl]amino]propanamide
CID 43627349
5-[(2,3-dichlorophenyl)methylamino]-2-methylpentan-1-ol
CID 103859612
2-(2-chlorophenyl)sulfanyl-N-(5-hydroxy-4-methylpentyl)acetamide
CID 103862035
N-(2,6-dichlorophenyl)-2-[2-[ethyl(methyl)amino]ethylamino]acetamide
CID 62642488
N-(2,6-dichlorophenyl)-3-methylbutanamide
CID 849070
2-(2-cyclopentylethylamino)-N-(2,6-dichlorophenyl)acetamide
CID 60919366
5-[(2-chloro-6-nitrophenyl)methylamino]-2-methylpentan-1-ol
CID 106160035
(E)-3-(2,6-dichlorophenyl)-N-(5-hydroxy-4-methylpentyl)prop-2-enamide
CID 103861642
N-(2,6-dichlorophenyl)-2-[(4-hydroxy-1-methoxybutan-2-yl)amino]acetamide
CID 106159615
2-[(2-chlorophenyl)methylamino]-N-(2,6-dichlorophenyl)acetamide
CID 43405213
N-(2,6-dichlorophenyl)-2-(4-methylanilino)acetamide
CID 39445182

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide?
The IUPAC name of N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide (CID 106160091) is N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide.
What is the SMILES notation for N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide?
The canonical SMILES for N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide is CC(CO)CCCNCC(=O)Nc1c(Cl)cccc1Cl.
What is the InChIKey of N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide?
The InChIKey is DORJWXJFFDBNDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O2/c1-10(9-19)4-3-7-17-8-13(20)18-14-11(15)5-2-6-12(14)16/h2,5-6,10,17,19H,3-4,7-9H2,1H3,(H,18,20).
What are the key properties of N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide?
N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide has a molecular weight of 319.23 g/mol, XLogP of 2.93, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dichlorophenyl)-2-[(5-hydroxy-4-methylpentyl)amino]acetamide is sourced from PubChem (CID 106160091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).