N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide

C16H25N3O2 — CID 40700700

IUPACN-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide
SMILESCCNC(=O)CN(CC)CC(=O)NCc1ccccc1C
InChIInChI=1S/C16H25N3O2/c1-4-17-15(20)11-19(5-2)12-16(21)18-10-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyZOAAATIIGBQZCS-UHFFFAOYSA-N
MW291.39 g/mol
LogP1.07
Rot. Bonds8

About N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide

N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide (PubChem CID 40700700) has the molecular formula C16H25N3O2 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide
PubChem CID40700700
Molecular FormulaC16H25N3O2
Molecular Weight291.39 g/mol
Exact Mass291.19
IUPAC NameN-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide
SMILESCCNC(=O)CN(CC)CC(=O)NCc1ccccc1C
InChIInChI=1S/C16H25N3O2/c1-4-17-15(20)11-19(5-2)12-16(21)18-10-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyZOAAATIIGBQZCS-UHFFFAOYSA-N
XLogP1.07
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 51.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[ethyl-[2-[methyl-[(2-methylphenyl)methyl]amino]-2-oxoethyl]amino]acetamide
CID 27075004
N-ethyl-2-[ethyl-[2-(2-methylanilino)-2-oxoethyl]amino]acetamide
CID 9432874
N-ethyl-2-[ethyl-(2-oxo-3-phenylpropyl)amino]acetamide
CID 62030498
N-ethyl-2-[ethyl-[2-(furan-2-ylmethylamino)-2-oxoethyl]amino]acetamide
CID 26519118
2-chloro-N-[(2-methylphenyl)methyl]acetamide
CID 9291148
2-[ethyl-[(2-methylphenyl)methylcarbamoyl]amino]acetic acid
CID 61205004
2-[acetyl-[2-(dimethylamino)ethyl]amino]-N-[(2-methylphenyl)methyl]acetamide
CID 113160407
2-[cyclohexyl(methyl)amino]-N-[(2-methylphenyl)methyl]acetamide
CID 51224648
2-[methyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]propanoic acid;hydrochloride
CID 119913207
2-[acetyl(benzyl)amino]-N-[(2-methylphenyl)methyl]acetamide
CID 113161182
N-benzyl-2-(diethylamino)acetamide
CID 969777
N-[(2-methylphenyl)methyl]-2-[(2-methylphenyl)methylamino]acetamide
CID 108996489

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide (CID 40700700) is N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide is CCNC(=O)CN(CC)CC(=O)NCc1ccccc1C.
What is the InChIKey of N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide?
The InChIKey is ZOAAATIIGBQZCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O2/c1-4-17-15(20)11-19(5-2)12-16(21)18-10-14-9-7-6-8-13(14)3/h6-9H,4-5,10-12H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide?
N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide has a molecular weight of 291.39 g/mol, XLogP of 1.07, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]amino]acetamide is sourced from PubChem (CID 40700700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).