2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide

C15H20ClNO3 — CID 43576645

IUPAC2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
SMILESCc1cc(Cl)ccc1OC(C)C(=O)N(CCO)C1CC1
InChIInChI=1S/C15H20ClNO3/c1-10-9-12(16)3-6-14(10)20-11(2)15(19)17(7-8-18)13-4-5-13/h3,6,9,11,13,18H,4-5,7-8H2,1-2H3
InChIKeyURTJTIZALXYJHL-UHFFFAOYSA-N
MW297.78 g/mol
LogP2.40
Rot. Bonds6

About 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide

2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide (PubChem CID 43576645) has the molecular formula C15H20ClNO3 and a molecular weight of 297.78 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
PubChem CID43576645
Molecular FormulaC15H20ClNO3
Molecular Weight297.78 g/mol
Exact Mass297.11
IUPAC Name2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
SMILESCc1cc(Cl)ccc1OC(C)C(=O)N(CCO)C1CC1
InChIInChI=1S/C15H20ClNO3/c1-10-9-12(16)3-6-14(10)20-11(2)15(19)17(7-8-18)13-4-5-13/h3,6,9,11,13,18H,4-5,7-8H2,1-2H3
InChIKeyURTJTIZALXYJHL-UHFFFAOYSA-N
XLogP2.40
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.78
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-2-(2,4-dichlorophenoxy)-N-(2-hydroxyethyl)propanamide
CID 102684163
2-(2-cyanophenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide
CID 43576582
2-(4-chloro-2-methylphenoxy)-N-(cyclopropylmethyl)propanamide
CID 86921283
2-(4-chloro-2-methylphenoxy)-N-methyl-N-(2-pyrrolidin-1-ylethyl)propanamide
CID 56509742
2-(4-chloro-2-methylphenoxy)-N-(2-hydroxy-2-methylpropyl)-N-methylpropanamide
CID 79291324
azane;2-(4-chloro-2-methylphenoxy)propanoic acid
CID 13376687
2-(4-chloro-2-methylphenoxy)-N-(4-hydroxybutan-2-yl)propanamide
CID 81047647
N-benzyl-2-(4-chloro-2-methylphenoxy)-N-methylpropanamide
CID 112787380
2-[[1-[2-(4-chloro-2-methylphenoxy)propanoyl]piperidin-4-yl]-methylamino]acetic acid
CID 129003108
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxypropanamide
CID 102684586
2-(4-chlorophenyl)-N-cyclopropyl-N-(2-hydroxyethyl)-3-methylbutanamide
CID 43576559
potassium;2-(4-chloro-2-methylphenoxy)propanoic acid;hydride
CID 173089242

Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The IUPAC name of 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide (CID 43576645) is 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide is Cc1cc(Cl)ccc1OC(C)C(=O)N(CCO)C1CC1.
What is the InChIKey of 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
The InChIKey is URTJTIZALXYJHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO3/c1-10-9-12(16)3-6-14(10)20-11(2)15(19)17(7-8-18)13-4-5-13/h3,6,9,11,13,18H,4-5,7-8H2,1-2H3.
What are the key properties of 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide?
2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide has a molecular weight of 297.78 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenoxy)-N-cyclopropyl-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 43576645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).