N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide

C12H19N3O — CID 43263109

IUPACN-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide
SMILESCCN(C)CC(=O)Nc1ccccc1CN
InChIInChI=1S/C12H19N3O/c1-3-15(2)9-12(16)14-11-7-5-4-6-10(11)8-13/h4-7H,3,8-9,13H2,1-2H3,(H,14,16)
InChIKeySCIBMUDDLJCHFR-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.04
Rot. Bonds5

About N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide

N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide (PubChem CID 43263109) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide
PubChem CID43263109
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC NameN-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide
SMILESCCN(C)CC(=O)Nc1ccccc1CN
InChIInChI=1S/C12H19N3O/c1-3-15(2)9-12(16)14-11-7-5-4-6-10(11)8-13/h4-7H,3,8-9,13H2,1-2H3,(H,14,16)
InChIKeySCIBMUDDLJCHFR-UHFFFAOYSA-N
XLogP1.04
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(aminomethyl)phenyl]-2-[methyl(propyl)amino]acetamide
CID 43270948
N-[2-(aminomethyl)phenyl]-2-[(2-hydroxy-2-methylpropyl)-methylamino]acetamide
CID 79380817
N-[2-(aminomethyl)phenyl]-2-[methyl(pentan-3-yl)amino]acetamide
CID 43570704
N-[2-(aminomethyl)phenyl]-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 79380838
2-[[2-[[2-(2-ethylanilino)-2-oxoethyl]-methylamino]acetyl]amino]benzamide
CID 18135262
N-[2-(aminomethyl)phenyl]-4-[methyl(pentyl)amino]butanamide
CID 43294538
N-(2-ethylphenyl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 27095559
N-[2-(aminomethyl)phenyl]carbamoyl chloride
CID 142823786
N-(2-ethylphenyl)-2-[3-hydroxybutyl(methyl)amino]acetamide
CID 111488425
N-(2,6-diethylphenyl)-2-[ethyl(methyl)amino]acetamide
CID 60516664
N-[2-(aminomethyl)phenyl]-2-[(1,1-dioxothiolan-3-yl)-methylamino]acetamide
CID 43648575
2-[[2-(3,5-dimethylanilino)-2-oxoethyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 9304031

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide?
The IUPAC name of N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide (CID 43263109) is N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide.
What is the SMILES notation for N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide?
The canonical SMILES for N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide is CCN(C)CC(=O)Nc1ccccc1CN.
What is the InChIKey of N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide?
The InChIKey is SCIBMUDDLJCHFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-15(2)9-12(16)14-11-7-5-4-6-10(11)8-13/h4-7H,3,8-9,13H2,1-2H3,(H,14,16).
What are the key properties of N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide?
N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide has a molecular weight of 221.30 g/mol, XLogP of 1.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)phenyl]-2-[ethyl(methyl)amino]acetamide is sourced from PubChem (CID 43263109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).