N-(3-acetamidophenyl)-2-aminohexanamide

C14H21N3O2 — CID 60852572

IUPACN-(3-acetamidophenyl)-2-aminohexanamide
SMILESCCCCC(N)C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C14H21N3O2/c1-3-4-8-13(15)14(19)17-12-7-5-6-11(9-12)16-10(2)18/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyWAMWNSFDXZTVPW-UHFFFAOYSA-N
MW263.34 g/mol
LogP2.10
Rot. Bonds6

About N-(3-acetamidophenyl)-2-aminohexanamide

N-(3-acetamidophenyl)-2-aminohexanamide (PubChem CID 60852572) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-aminohexanamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-aminohexanamide
PubChem CID60852572
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC NameN-(3-acetamidophenyl)-2-aminohexanamide
SMILESCCCCC(N)C(=O)Nc1cccc(NC(C)=O)c1
InChIInChI=1S/C14H21N3O2/c1-3-4-8-13(15)14(19)17-12-7-5-6-11(9-12)16-10(2)18/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyWAMWNSFDXZTVPW-UHFFFAOYSA-N
XLogP2.10
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 52.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-(3-acetamidophenyl)-2-aminohexanamide 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

2-[3-[[(2S)-2-aminohexanoyl]amino]phenyl]acetic acid
CID 107145776
(2S)-2-amino-N-(3-sulfamoylphenyl)hexanamide
CID 107143839
2-amino-N-(3-ethynylphenyl)hexanamide
CID 60852206
N-[3-[[acetyl(methyl)amino]methyl]phenyl]-2-aminohexanamide
CID 60854220
2-amino-N-[3-(carbamoylamino)phenyl]pentanamide
CID 43710986
2-amino-N-[3-(methylsulfamoyl)phenyl]hexanamide
CID 60854034
(2S)-2-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]hexanamide
CID 103831187
N-(3-acetamidophenyl)-2-amino-3-methoxypropanamide;hydrochloride
CID 120983461
N-(3-acetamidophenyl)-2-aminobutanediamide
CID 60847053
(2R)-N-(4-acetamidophenyl)-2-aminopentanamide
CID 113263757
(2S)-N-(3-acetamidophenyl)-2-amino-3-phenylpropanamide
CID 22691247
N-(5-acetamido-2-methoxyphenyl)-2-aminohexanamide
CID 60853865

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-aminohexanamide?
The IUPAC name of N-(3-acetamidophenyl)-2-aminohexanamide (CID 60852572) is N-(3-acetamidophenyl)-2-aminohexanamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-aminohexanamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-aminohexanamide is CCCCC(N)C(=O)Nc1cccc(NC(C)=O)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-aminohexanamide?
The InChIKey is WAMWNSFDXZTVPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-3-4-8-13(15)14(19)17-12-7-5-6-11(9-12)16-10(2)18/h5-7,9,13H,3-4,8,15H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(3-acetamidophenyl)-2-aminohexanamide?
N-(3-acetamidophenyl)-2-aminohexanamide has a molecular weight of 263.34 g/mol, XLogP of 2.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-aminohexanamide is sourced from PubChem (CID 60852572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).