5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide

C14H20Cl2N2O — CID 82017216

IUPAC5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H20Cl2N2O/c1-10(9-17)2-5-14(19)18-7-6-11-3-4-12(15)8-13(11)16/h3-4,8,10H,2,5-7,9,17H2,1H3,(H,18,19)
InChIKeyOZSAULCADOSEIL-UHFFFAOYSA-N
MW303.23 g/mol
LogP3.03
Rot. Bonds7

About 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide

5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide (PubChem CID 82017216) has the molecular formula C14H20Cl2N2O and a molecular weight of 303.23 g/mol. Its IUPAC name is 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide.

Molecular Properties

Compound Name5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide
PubChem CID82017216
Molecular FormulaC14H20Cl2N2O
Molecular Weight303.23 g/mol
Exact Mass302.10
IUPAC Name5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide
SMILESCC(CN)CCC(=O)NCCc1ccc(Cl)cc1Cl
InChIInChI=1S/C14H20Cl2N2O/c1-10(9-17)2-5-14(19)18-7-6-11-3-4-12(15)8-13(11)16/h3-4,8,10H,2,5-7,9,17H2,1H3,(H,18,19)
InChIKeyOZSAULCADOSEIL-UHFFFAOYSA-N
XLogP3.03
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.23
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-amino-1-(2,4-dichlorophenyl)-5-methylhexan-2-one
CID 116607435
4-[2-(2,4-dichlorophenyl)ethylamino]-4-oxobutanoic acid
CID 9151806
2-amino-N-[2-(2,4-dichlorophenyl)ethyl]propanamide;hydrochloride
CID 119263877
(2R)-2-amino-N-[2-(2,4-dichlorophenyl)ethyl]propanamide;hydrochloride
CID 119263879
5-amino-N-(2,4-dichlorophenyl)-4-methylpentanamide
CID 82683232
N-(3-aminopropyl)-3-(2,4-dichlorophenyl)propanamide;hydrochloride
CID 119408221
5-[3-(2,4-dichlorophenyl)propanoylamino]-2-methylpentanoic acid
CID 104681872
3-(2,4-dichlorophenyl)-N-(4-hydroxy-2-methylpentyl)propanamide
CID 111447770
4-amino-5-[2-(2,4-dichlorophenyl)ethylamino]-5-oxopentanoic acid
CID 64895020
2-bromo-N-[2-(2,4-dichlorophenyl)ethyl]-3-methylbutanamide
CID 43095602
3-amino-N-[2-(2-chloro-4-methoxyphenyl)ethyl]propanamide
CID 115153007
2-amino-N-[2-(2,4-dichlorophenyl)ethyl]pentanamide;hydrochloride
CID 119263881

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide?
The IUPAC name of 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide (CID 82017216) is 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide.
What is the SMILES notation for 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide?
The canonical SMILES for 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide is CC(CN)CCC(=O)NCCc1ccc(Cl)cc1Cl.
What is the InChIKey of 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide?
The InChIKey is OZSAULCADOSEIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Cl2N2O/c1-10(9-17)2-5-14(19)18-7-6-11-3-4-12(15)8-13(11)16/h3-4,8,10H,2,5-7,9,17H2,1H3,(H,18,19).
What are the key properties of 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide?
5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide has a molecular weight of 303.23 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(2,4-dichlorophenyl)ethyl]-4-methylpentanamide is sourced from PubChem (CID 82017216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).