N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride

C20H28ClN3O2 — CID 119607385

IUPACN-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl
InChIInChI=1S/C20H27N3O2.ClH/c1-14(2)20(3,13-21)23-19(25)12-22-18(24)11-16-9-6-8-15-7-4-5-10-17(15)16;/h4-10,14H,11-13,21H2,1-3H3,(H,22,24)(H,23,25);1H
InChIKeyGDMABQZXLGJRBG-UHFFFAOYSA-N
MW377.92 g/mol
LogP2.41
Rot. Bonds7

About N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride

N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride (PubChem CID 119607385) has the molecular formula C20H28ClN3O2 and a molecular weight of 377.92 g/mol. Its IUPAC name is N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
PubChem CID119607385
Molecular FormulaC20H28ClN3O2
Molecular Weight377.92 g/mol
Exact Mass377.19
IUPAC NameN-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
SMILESCC(C)C(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl
InChIInChI=1S/C20H27N3O2.ClH/c1-14(2)20(3,13-21)23-19(25)12-22-18(24)11-16-9-6-8-15-7-4-5-10-17(15)16;/h4-10,14H,11-13,21H2,1-3H3,(H,22,24)(H,23,25);1H
InChIKeyGDMABQZXLGJRBG-UHFFFAOYSA-N
XLogP2.41
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.92
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride with MolForge

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Related Compounds

N-[2-[(1-amino-2,4-dimethylpentan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
CID 119599008
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-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-(3-fluorophenyl)acetamide
CID 119607062
N-[2-[2-(methylamino)propylamino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride
CID 120831392
N-[2-(ethylamino)-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 18145666
N-(1-amino-2,3-dimethylbutan-2-yl)-2-phenylacetamide;hydrochloride
CID 119608428
N-(2-hydroxy-2-methylpropyl)-2-naphthalen-1-ylacetamide
CID 65110602
N-[2-[2-(3-methylbutanoyl)hydrazinyl]-2-oxoethyl]-2-naphthalen-1-ylacetamide
CID 46423856
N-(2-amino-2-oxoethyl)-2-naphthalen-1-ylacetamide
CID 9294847
2-[[2-[(2-naphthalen-1-ylacetyl)amino]acetyl]amino]acetic acid
CID 108797411
N-(1-amino-2-cyclopropylpropan-2-yl)-2-naphthalen-1-ylacetamide;hydrochloride
CID 119574755

Frequently Asked Questions

What is the IUPAC name of N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The IUPAC name of N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride (CID 119607385) is N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride.
What is the SMILES notation for N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The canonical SMILES for N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride is CC(C)C(C)(CN)NC(=O)CNC(=O)Cc1cccc2ccccc12.Cl.
What is the InChIKey of N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
The InChIKey is GDMABQZXLGJRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2.ClH/c1-14(2)20(3,13-21)23-19(25)12-22-18(24)11-16-9-6-8-15-7-4-5-10-17(15)16;/h4-10,14H,11-13,21H2,1-3H3,(H,22,24)(H,23,25);1H.
What are the key properties of N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride?
N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride has a molecular weight of 377.92 g/mol, XLogP of 2.41, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(1-amino-2,3-dimethylbutan-2-yl)amino]-2-oxoethyl]-2-naphthalen-1-ylacetamide;hydrochloride is sourced from PubChem (CID 119607385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).