3-[2-(1-cyclopropylethylamino)phenoxy]propanamide

C14H20N2O2 — CID 43729791

IUPAC3-[2-(1-cyclopropylethylamino)phenoxy]propanamide
SMILESCC(Nc1ccccc1OCCC(N)=O)C1CC1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-7-11)16-12-4-2-3-5-13(12)18-9-8-14(15)17/h2-5,10-11,16H,6-9H2,1H3,(H2,15,17)
InChIKeyZJFLFFODKBYCIP-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.15
Rot. Bonds7

About 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide

3-[2-(1-cyclopropylethylamino)phenoxy]propanamide (PubChem CID 43729791) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide.

Molecular Properties

Compound Name3-[2-(1-cyclopropylethylamino)phenoxy]propanamide
PubChem CID43729791
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-[2-(1-cyclopropylethylamino)phenoxy]propanamide
SMILESCC(Nc1ccccc1OCCC(N)=O)C1CC1
InChIInChI=1S/C14H20N2O2/c1-10(11-6-7-11)16-12-4-2-3-5-13(12)18-9-8-14(15)17/h2-5,10-11,16H,6-9H2,1H3,(H2,15,17)
InChIKeyZJFLFFODKBYCIP-UHFFFAOYSA-N
XLogP2.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide 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

3-[2-(1-cyclopropylpropan-2-ylamino)phenoxy]propanamide
CID 115929140
2-[2-(3-amino-3-oxopropoxy)anilino]propanoic acid
CID 66173726
3-[2-(1-methoxypropan-2-ylamino)phenoxy]propanamide
CID 62534715
3-[2-(1-pyrrolidin-2-ylpropan-2-ylamino)phenoxy]propanamide
CID 79538032
3-[2-(heptan-4-ylamino)phenoxy]propanamide
CID 43729781
N-[2-(3-amino-3-oxopropoxy)phenyl]-2-methylpropanamide
CID 47239947
N-[2-(3-amino-3-oxopropoxy)phenyl]-2-bromopropanamide
CID 114014367
3-[2-[(2,6-dimethylcyclohexyl)amino]phenoxy]propanamide
CID 43729752
N-[1-(1-methylpiperidin-4-yl)ethyl]-2-propoxyaniline
CID 43682215
2-amino-N-[2-(3-amino-3-oxopropoxy)phenyl]-3-methylbutanamide
CID 43712567
(2S,3S)-2-amino-N-[2-(3-amino-3-oxopropoxy)phenyl]-3-methylpentanamide
CID 61178634
3-[4-(1-cyclopentylethylamino)phenoxy]propanamide
CID 62631553

Frequently Asked Questions

What is the IUPAC name of 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide?
The IUPAC name of 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide (CID 43729791) is 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide.
What is the SMILES notation for 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide?
The canonical SMILES for 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide is CC(Nc1ccccc1OCCC(N)=O)C1CC1.
What is the InChIKey of 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide?
The InChIKey is ZJFLFFODKBYCIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10(11-6-7-11)16-12-4-2-3-5-13(12)18-9-8-14(15)17/h2-5,10-11,16H,6-9H2,1H3,(H2,15,17).
What are the key properties of 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide?
3-[2-(1-cyclopropylethylamino)phenoxy]propanamide has a molecular weight of 248.33 g/mol, XLogP of 2.15, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1-cyclopropylethylamino)phenoxy]propanamide is sourced from PubChem (CID 43729791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).