2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide

C14H19ClN2O3 — CID 4720829

IUPAC2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide
SMILESCCOc1cc(CNC2CC2)cc(Cl)c1OCC(N)=O
InChIInChI=1S/C14H19ClN2O3/c1-2-19-12-6-9(7-17-10-3-4-10)5-11(15)14(12)20-8-13(16)18/h5-6,10,17H,2-4,7-8H2,1H3,(H2,16,18)
InChIKeySRQKKINSQJPZKC-UHFFFAOYSA-N
MW298.77 g/mol
LogP1.85
Rot. Bonds8

About 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide

2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide (PubChem CID 4720829) has the molecular formula C14H19ClN2O3 and a molecular weight of 298.77 g/mol. Its IUPAC name is 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide.

Molecular Properties

Compound Name2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide
PubChem CID4720829
Molecular FormulaC14H19ClN2O3
Molecular Weight298.77 g/mol
Exact Mass298.11
IUPAC Name2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide
SMILESCCOc1cc(CNC2CC2)cc(Cl)c1OCC(N)=O
InChIInChI=1S/C14H19ClN2O3/c1-2-19-12-6-9(7-17-10-3-4-10)5-11(15)14(12)20-8-13(16)18/h5-6,10,17H,2-4,7-8H2,1H3,(H2,16,18)
InChIKeySRQKKINSQJPZKC-UHFFFAOYSA-N
XLogP1.85
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-chloro-4-[(cyclooctylamino)methyl]-6-ethoxyphenoxy]acetamide
CID 4721368
2-[2-chloro-4-[(cyclopropylamino)methyl]-6-methoxyphenoxy]acetamide
CID 4720907
N-[(3-chloro-4,5-diethoxyphenyl)methyl]cyclopentanamine
CID 4717339
N-[(3-chloro-5-ethoxy-4-propoxyphenyl)methyl]cyclopropanamine
CID 29226592
N-[(3-chloro-4,5-diethoxyphenyl)methyl]cyclooctanamine;hydrochloride
CID 17295895
2-[2-chloro-6-methoxy-4-[[(1-propan-2-ylpiperidin-4-yl)amino]methyl]phenoxy]acetamide
CID 119163902
2-[2-chloro-6-ethoxy-4-[[(1-hydroxy-2-methylpropan-2-yl)amino]methyl]phenoxy]acetamide
CID 964295
2-[2-chloro-6-ethoxy-4-[[3-(methylamino)propylamino]methyl]phenoxy]acetamide
CID 4720831
2-[2-chloro-6-ethoxy-4-[[(4-fluorophenyl)methylamino]methyl]phenoxy]acetamide;hydrochloride
CID 17293050
2-[2-chloro-4-[[2-(diethylamino)ethylamino]methyl]-6-ethoxyphenoxy]acetamide;dihydrochloride
CID 17295349
2-[4-[[(1-benzylpiperidin-4-yl)amino]methyl]-2-bromo-6-ethoxyphenoxy]acetamide;dihydrochloride
CID 17159140
2-[2-chloro-6-ethoxy-4-[[(1-ethyltetrazol-5-yl)amino]methyl]phenoxy]acetamide
CID 4727524

Frequently Asked Questions

What is the IUPAC name of 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide?
The IUPAC name of 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide (CID 4720829) is 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide.
What is the SMILES notation for 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide?
The canonical SMILES for 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide is CCOc1cc(CNC2CC2)cc(Cl)c1OCC(N)=O.
What is the InChIKey of 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide?
The InChIKey is SRQKKINSQJPZKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3/c1-2-19-12-6-9(7-17-10-3-4-10)5-11(15)14(12)20-8-13(16)18/h5-6,10,17H,2-4,7-8H2,1H3,(H2,16,18).
What are the key properties of 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide?
2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide has a molecular weight of 298.77 g/mol, XLogP of 1.85, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-chloro-4-[(cyclopropylamino)methyl]-6-ethoxyphenoxy]acetamide is sourced from PubChem (CID 4720829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).