N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide

C13H20ClN3O2 — CID 61444928

IUPACN-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
SMILESCCN(CCOC)CC(=O)Nc1ccc(Cl)c(N)c1
InChIInChI=1S/C13H20ClN3O2/c1-3-17(6-7-19-2)9-13(18)16-10-4-5-11(14)12(15)8-10/h4-5,8H,3,6-7,9,15H2,1-2H3,(H,16,18)
InChIKeyJLYABSBQFRIMRD-UHFFFAOYSA-N
MW285.78 g/mol
LogP1.83
Rot. Bonds7

About N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide

N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide (PubChem CID 61444928) has the molecular formula C13H20ClN3O2 and a molecular weight of 285.78 g/mol. Its IUPAC name is N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
PubChem CID61444928
Molecular FormulaC13H20ClN3O2
Molecular Weight285.78 g/mol
Exact Mass285.12
IUPAC NameN-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
SMILESCCN(CCOC)CC(=O)Nc1ccc(Cl)c(N)c1
InChIInChI=1S/C13H20ClN3O2/c1-3-17(6-7-19-2)9-13(18)16-10-4-5-11(14)12(15)8-10/h4-5,8H,3,6-7,9,15H2,1-2H3,(H,16,18)
InChIKeyJLYABSBQFRIMRD-UHFFFAOYSA-N
XLogP1.83
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-chlorophenyl)-2-[3-methoxypropyl(methyl)amino]acetamide
CID 62984614
N-(3-amino-4-chlorophenyl)-2-[ethyl(2-ethylbutyl)amino]acetamide
CID 43587466
N-(3-amino-4-chlorophenyl)-2-[ethyl(methyl)amino]acetamide
CID 43263033
N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methylbutyl)amino]acetamide
CID 79477796
2-[ethyl(2-methoxyethyl)amino]-N-[3-(methylamino)phenyl]acetamide
CID 71219508
N-(3-amino-4-methylphenyl)-2-[2-ethoxyethyl(ethyl)amino]acetamide
CID 63698404
N-(3-amino-4-chlorophenyl)-2-(2-methoxyethylsulfonyl)acetamide
CID 43446244
N-(4-carbamothioylphenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
CID 61448483
N-(3-amino-4-chlorophenyl)-2-[cyclopropylmethyl(propyl)amino]acetamide
CID 43588022
N-(3,4-diaminophenyl)-2-(diethylamino)acetamide
CID 66593690
N-(3-carbamothioylphenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
CID 61448387
N-(4-cyanophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide
CID 61448468

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide?
The IUPAC name of N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide (CID 61444928) is N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide.
What is the SMILES notation for N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide?
The canonical SMILES for N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide is CCN(CCOC)CC(=O)Nc1ccc(Cl)c(N)c1.
What is the InChIKey of N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide?
The InChIKey is JLYABSBQFRIMRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20ClN3O2/c1-3-17(6-7-19-2)9-13(18)16-10-4-5-11(14)12(15)8-10/h4-5,8H,3,6-7,9,15H2,1-2H3,(H,16,18).
What are the key properties of N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide?
N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide has a molecular weight of 285.78 g/mol, XLogP of 1.83, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-chlorophenyl)-2-[ethyl(2-methoxyethyl)amino]acetamide is sourced from PubChem (CID 61444928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).