2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide

C15H20ClNO3 — CID 114751285

IUPAC2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCC1(CCO)CC1
InChIInChI=1S/C15H20ClNO3/c1-11(20-13-5-3-2-4-12(13)16)14(19)17-10-15(6-7-15)8-9-18/h2-5,11,18H,6-10H2,1H3,(H,17,19)
InChIKeyJTJCYKAJSXLKHJ-UHFFFAOYSA-N
MW297.78 g/mol
LogP2.39
Rot. Bonds7

About 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide

2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide (PubChem CID 114751285) has the molecular formula C15H20ClNO3 and a molecular weight of 297.78 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
PubChem CID114751285
Molecular FormulaC15H20ClNO3
Molecular Weight297.78 g/mol
Exact Mass297.11
IUPAC Name2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)NCC1(CCO)CC1
InChIInChI=1S/C15H20ClNO3/c1-11(20-13-5-3-2-4-12(13)16)14(19)17-10-15(6-7-15)8-9-18/h2-5,11,18H,6-10H2,1H3,(H,17,19)
InChIKeyJTJCYKAJSXLKHJ-UHFFFAOYSA-N
XLogP2.39
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.78
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide
CID 114751607
2-(2-chlorophenoxy)-N-[(2S)-2-hydroxypropyl]propanamide
CID 83030471
2-(2-chlorophenoxy)-N-[2-(ethylamino)ethyl]propanamide;hydrochloride
CID 119506587
2-(2-chlorophenoxy)-N-[3-(methylamino)propyl]propanamide;hydrochloride
CID 119431400
2-(2-chlorophenoxy)-N-(2-chloroprop-2-enyl)propanamide
CID 115636700
2-(2-chlorophenoxy)-N-[2-oxo-2-(propan-2-ylamino)ethyl]propanamide
CID 43058809
(2R)-2-(2-chlorophenoxy)-N-(ethylcarbamoyl)propanamide
CID 2631962
methyl 3-[2-(2-chlorophenoxy)propanoylamino]propanoate
CID 60739964
2-(2-chlorophenoxy)-N-(2-hydroxy-2-methylbutyl)propanamide
CID 65114505
2-(2-chlorophenoxy)-N-(3-hydroxy-4-methylpentyl)propanamide
CID 111460590
(2S)-2-(2-chlorophenoxy)-N-(3-methoxypropyl)propanamide
CID 42561381
2-(2,3-dichlorophenoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]propanamide;hydrochloride
CID 120890520

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide (CID 114751285) is 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide is CC(Oc1ccccc1Cl)C(=O)NCC1(CCO)CC1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide?
The InChIKey is JTJCYKAJSXLKHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO3/c1-11(20-13-5-3-2-4-12(13)16)14(19)17-10-15(6-7-15)8-9-18/h2-5,11,18H,6-10H2,1H3,(H,17,19).
What are the key properties of 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide?
2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide has a molecular weight of 297.78 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]propanamide is sourced from PubChem (CID 114751285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).