N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride

C14H23ClN2O — CID 120832068

IUPACN-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride
SMILESCNC(C)CNC(=O)CCc1cccc(C)c1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-11-5-4-6-13(9-11)7-8-14(17)16-10-12(2)15-3;/h4-6,9,12,15H,7-8,10H2,1-3H3,(H,16,17);1H
InChIKeyQKZUHCBVNMCERF-UHFFFAOYSA-N
MW270.80 g/mol
LogP2.07
Rot. Bonds6

About N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride

N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride (PubChem CID 120832068) has the molecular formula C14H23ClN2O and a molecular weight of 270.80 g/mol. Its IUPAC name is N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride.

Molecular Properties

Compound NameN-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride
PubChem CID120832068
Molecular FormulaC14H23ClN2O
Molecular Weight270.80 g/mol
Exact Mass270.15
IUPAC NameN-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride
SMILESCNC(C)CNC(=O)CCc1cccc(C)c1.Cl
InChIInChI=1S/C14H22N2O.ClH/c1-11-5-4-6-13(9-11)7-8-14(17)16-10-12(2)15-3;/h4-6,9,12,15H,7-8,10H2,1-3H3,(H,16,17);1H
InChIKeyQKZUHCBVNMCERF-UHFFFAOYSA-N
XLogP2.07
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.80
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride 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-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanoic acid
CID 66165783
(2S)-2-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanoic acid
CID 114006419
2-hydroxy-3-[3-(3-methylphenyl)propanoylamino]propanamide
CID 114152434
N-[2-(methylamino)propyl]-2-(3-methylphenoxy)acetamide;hydrochloride
CID 120828955
N-(3-aminobutyl)-3-(3-methylphenyl)propanamide;hydrochloride
CID 119494888
3-(methylamino)-N-[2-(3-methylphenyl)ethyl]butanamide
CID 110838222
3-(3,4-dichlorophenyl)-N-[2-(methylamino)propyl]propanamide
CID 120831265
N-(2-bromo-2-phenylethyl)-3-(3-methylphenyl)propanamide
CID 114308268
3-(3-methylphenyl)-N-(2-methylsulfonylethyl)propanamide
CID 47327011
N-(3-aminopropyl)-3-(3-methylphenyl)propanamide;hydrochloride
CID 119404890
N-(3-bromopropyl)-3-(3-methylphenyl)propanamide
CID 62365535
N-(4-hydroxybutyl)-3-(3-methylphenyl)propanamide
CID 106843245

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride?
The IUPAC name of N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride (CID 120832068) is N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride.
What is the SMILES notation for N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride?
The canonical SMILES for N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride is CNC(C)CNC(=O)CCc1cccc(C)c1.Cl.
What is the InChIKey of N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride?
The InChIKey is QKZUHCBVNMCERF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O.ClH/c1-11-5-4-6-13(9-11)7-8-14(17)16-10-12(2)15-3;/h4-6,9,12,15H,7-8,10H2,1-3H3,(H,16,17);1H.
What are the key properties of N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride?
N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride has a molecular weight of 270.80 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)propyl]-3-(3-methylphenyl)propanamide;hydrochloride is sourced from PubChem (CID 120832068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).