N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride

C21H30ClN3O2 — CID 119599008

IUPACN-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
SMILESCC(C)CC(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl
InChIInChI=1S/C21H29N3O2.ClH/c1-15(2)12-21(3,14-22)24-20(26)13-23-19(25)11-17-9-6-8-16-7-4-5-10-18(16)17;/h4-10,15H,11-14,22H2,1-3H3,(H,23,25)(H,24,26);1H
InChIKeyLRIDJPFZEOQIGG-UHFFFAOYSA-N
MW391.94 g/mol
LogP2.80
Rot. Bonds8

About N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride

N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride (PubChem CID 119599008) has the molecular formula C21H30ClN3O2 and a molecular weight of 391.94 g/mol. Its IUPAC name is N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
PubChem CID119599008
Molecular FormulaC21H30ClN3O2
Molecular Weight391.94 g/mol
Exact Mass391.20
IUPAC NameN-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
SMILESCC(C)CC(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl
InChIInChI=1S/C21H29N3O2.ClH/c1-15(2)12-21(3,14-22)24-20(26)13-23-19(25)11-17-9-6-8-16-7-4-5-10-18(16)17;/h4-10,15H,11-14,22H2,1-3H3,(H,23,25)(H,24,26);1H
InChIKeyLRIDJPFZEOQIGG-UHFFFAOYSA-N
XLogP2.80
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.94
LogP ≤ 52.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;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

N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
CID 119607385
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-methylphenyl)acetamide
CID 81424785
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2-bromophenyl)acetamide
CID 119599373
N-(1-amino-2,4-dimethylpentan-2-yl)-2-naphthalen-2-ylacetamide;hydrochloride
CID 119597467
N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]thiophene-2-carboxamide;hydrochloride
CID 119599344
N-(1-amino-2-methylpropan-2-yl)-2-naphthalen-1-ylacetamide;hydrochloride
CID 119523894
N-[2-(3-aminobutylamino)-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
CID 119497414
N-[2-[2-(3-methylbutanoyl)hydrazinyl]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 46423856
N-(1-amino-2,4-dimethylpentan-2-yl)-2-(2H-indazol-3-yl)acetamide;hydrochloride
CID 119599173
N-[2-[2-(methylamino)propylamino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
CID 120831392
N-(1-amino-2-cyclopropylpropan-2-yl)-2-naphthalen-1-ylacetamide;hydrochloride
CID 119574755
N-[2-(ethylamino)-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 18145666

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The IUPAC name of N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride (CID 119599008) is N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The canonical SMILES for N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride is CC(C)CC(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl.
What is the InChIKey of N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The InChIKey is LRIDJPFZEOQIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N3O2.ClH/c1-15(2)12-21(3,14-22)24-20(26)13-23-19(25)11-17-9-6-8-16-7-4-5-10-18(16)17;/h4-10,15H,11-14,22H2,1-3H3,(H,23,25)(H,24,26);1H.
What are the key properties of N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride has a molecular weight of 391.94 g/mol, XLogP of 2.80, 8 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride is sourced from PubChem (CID 119599008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).