2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide

C16H23ClN2O2 — CID 62074242

IUPAC2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide
SMILESCCCNC(C)c1cc(Cl)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C16H23ClN2O2/c1-3-8-18-11(2)14-9-12(17)4-7-15(14)21-10-16(20)19-13-5-6-13/h4,7,9,11,13,18H,3,5-6,8,10H2,1-2H3,(H,19,20)
InChIKeySLSXKVXHYKANDJ-UHFFFAOYSA-N
MW310.82 g/mol
LogP3.06
Rot. Bonds8

About 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide

2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide (PubChem CID 62074242) has the molecular formula C16H23ClN2O2 and a molecular weight of 310.82 g/mol. Its IUPAC name is 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide
PubChem CID62074242
Molecular FormulaC16H23ClN2O2
Molecular Weight310.82 g/mol
Exact Mass310.14
IUPAC Name2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide
SMILESCCCNC(C)c1cc(Cl)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C16H23ClN2O2/c1-3-8-18-11(2)14-9-12(17)4-7-15(14)21-10-16(20)19-13-5-6-13/h4,7,9,11,13,18H,3,5-6,8,10H2,1-2H3,(H,19,20)
InChIKeySLSXKVXHYKANDJ-UHFFFAOYSA-N
XLogP3.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.82
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide 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

N-cyclopropyl-2-[4-methyl-2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 43505232
2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]acetamide
CID 62074759
N-[1-[5-chloro-2-(2-chloroprop-2-enoxy)phenyl]ethyl]propan-1-amine
CID 63500138
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-cyclopropylacetamide
CID 54929439
2-[4-chloro-2-[1-(ethylamino)ethyl]phenoxy]-N-cyclopropyl-N-methylacetamide
CID 62072702
N-cyclopropyl-3-[1-(2,5-dichlorophenyl)ethylamino]propanamide
CID 79394410
2-[4-chloro-2-[1-(ethylamino)ethyl]phenoxy]-N-(2-methoxyethyl)acetamide
CID 62072700
2-[4-bromo-2-[1-(propylamino)ethyl]phenoxy]-N-ethylacetamide
CID 62393036
N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
CID 62628087
2-methylpropyl 4-[[2-(2,4-dichlorophenoxy)acetyl]amino]piperidine-1-carboxylate
CID 108561064
2-[4-chloro-2-[1-(methylamino)ethyl]phenoxy]-N-pentan-3-ylacetamide
CID 62074581
N-cyclopentyl-2-(2,5-dichlorophenoxy)acetamide
CID 841562

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide (CID 62074242) is 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide is CCCNC(C)c1cc(Cl)ccc1OCC(=O)NC1CC1.
What is the InChIKey of 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide?
The InChIKey is SLSXKVXHYKANDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23ClN2O2/c1-3-8-18-11(2)14-9-12(17)4-7-15(14)21-10-16(20)19-13-5-6-13/h4,7,9,11,13,18H,3,5-6,8,10H2,1-2H3,(H,19,20).
What are the key properties of 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide?
2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide has a molecular weight of 310.82 g/mol, XLogP of 3.06, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-2-[1-(propylamino)ethyl]phenoxy]-N-cyclopropylacetamide is sourced from PubChem (CID 62074242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).