N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride

C15H24ClN3O3 — CID 119714198

IUPACN-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride
SMILESCCNC(=O)c1ccc(NC(=O)CNCCOC)c(C)c1.Cl
InChIInChI=1S/C15H23N3O3.ClH/c1-4-17-15(20)12-5-6-13(11(2)9-12)18-14(19)10-16-7-8-21-3;/h5-6,9,16H,4,7-8,10H2,1-3H3,(H,17,20)(H,18,19);1H
InChIKeyLRCVFDIMVDNGCL-UHFFFAOYSA-N
MW329.83 g/mol
LogP1.34
Rot. Bonds8

About N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride

N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride (PubChem CID 119714198) has the molecular formula C15H24ClN3O3 and a molecular weight of 329.83 g/mol. Its IUPAC name is N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride
PubChem CID119714198
Molecular FormulaC15H24ClN3O3
Molecular Weight329.83 g/mol
Exact Mass329.15
IUPAC NameN-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride
SMILESCCNC(=O)c1ccc(NC(=O)CNCCOC)c(C)c1.Cl
InChIInChI=1S/C15H23N3O3.ClH/c1-4-17-15(20)12-5-6-13(11(2)9-12)18-14(19)10-16-7-8-21-3;/h5-6,9,16H,4,7-8,10H2,1-3H3,(H,17,20)(H,18,19);1H
InChIKeyLRCVFDIMVDNGCL-UHFFFAOYSA-N
XLogP1.34
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.83
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-3-methyl-4-[[2-(methylamino)acetyl]amino]benzamide;hydrochloride
CID 119714183
4-(3-aminopropanoylamino)-N-ethyl-3-methylbenzamide
CID 54862801
4-[[2-(2-aminoethoxy)acetyl]amino]-N-ethyl-3-methylbenzamide
CID 79473931
3-[[2-(2-methoxyethylamino)acetyl]amino]-4-methylbenzamide
CID 119711741
3-[[2-(cyclopropylmethylamino)acetyl]amino]-N-ethyl-4-methylbenzamide
CID 60867288
3-[[2-(2-methoxyethylamino)acetyl]amino]-4-methyl-N-phenylbenzamide
CID 119712036
N-(3-methoxy-2,4-dimethylphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119728792
N-(2-acetamido-5-methylphenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119707722
N-(2,4-difluorophenyl)-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119673290
N-(2-methoxyethyl)-3-methyl-4-(1,2,2-tricyanoethenylamino)benzamide
CID 168607620
N-[2-(5-bromo-2-methylanilino)-2-oxoethyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119762977
2-(2-methoxyethylamino)-N-[2-methyl-4-(thiomorpholin-4-ylmethyl)phenyl]acetamide;dihydrochloride
CID 119869930

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride?
The IUPAC name of N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride (CID 119714198) is N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride.
What is the SMILES notation for N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride?
The canonical SMILES for N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride is CCNC(=O)c1ccc(NC(=O)CNCCOC)c(C)c1.Cl.
What is the InChIKey of N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride?
The InChIKey is LRCVFDIMVDNGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3.ClH/c1-4-17-15(20)12-5-6-13(11(2)9-12)18-14(19)10-16-7-8-21-3;/h5-6,9,16H,4,7-8,10H2,1-3H3,(H,17,20)(H,18,19);1H.
What are the key properties of N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride?
N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride has a molecular weight of 329.83 g/mol, XLogP of 1.34, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[2-(2-methoxyethylamino)acetyl]amino]-3-methylbenzamide;hydrochloride is sourced from PubChem (CID 119714198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).