N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide

C15H23NO3 — CID 43573145

IUPACN-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
SMILESCc1cccc(OCCC(=O)N(CCO)C(C)C)c1
InChIInChI=1S/C15H23NO3/c1-12(2)16(8-9-17)15(18)7-10-19-14-6-4-5-13(3)11-14/h4-6,11-12,17H,7-10H2,1-3H3
InChIKeyUQDJUYUMGCQFMN-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.99
Rot. Bonds7

About N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide

N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide (PubChem CID 43573145) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
PubChem CID43573145
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
SMILESCc1cccc(OCCC(=O)N(CCO)C(C)C)c1
InChIInChI=1S/C15H23NO3/c1-12(2)16(8-9-17)15(18)7-10-19-14-6-4-5-13(3)11-14/h4-6,11-12,17H,7-10H2,1-3H3
InChIKeyUQDJUYUMGCQFMN-UHFFFAOYSA-N
XLogP1.99
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide
CID 80666425
3-(3-aminophenoxy)-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
CID 61094495
2-[2-(3-methylphenoxy)ethyl-propan-2-ylamino]ethanol
CID 60691972
N,N-dimethyl-3-(3-methylphenoxy)propanamide
CID 60637097
N-(2-hydroxyethyl)-3-(4-methoxyphenoxy)-N-propan-2-ylpropanamide
CID 43573753
N,N-bis(2-hydroxyethyl)-4-(3-methylphenoxy)butanamide
CID 60653323
N-(3-hydroxybutyl)-N-methyl-3-(3-methylphenoxy)propanamide
CID 115691597
N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-(2,2,2-trifluoroethyl)propanamide
CID 103915390
N-(2-aminoethyl)-N-methyl-3-(3-methylphenoxy)propanamide
CID 55149658
5-amino-N,4-dimethyl-N-[2-(3-methylphenoxy)ethyl]pentanamide
CID 82011195
1-hydroxy-4-(3-methylphenoxy)butan-2-one
CID 95437359
2-(3-chlorophenoxy)-N-(2-hydroxyethyl)-N-propan-2-ylacetamide
CID 43573280

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide?
The IUPAC name of N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide (CID 43573145) is N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide.
What is the SMILES notation for N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide?
The canonical SMILES for N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide is Cc1cccc(OCCC(=O)N(CCO)C(C)C)c1.
What is the InChIKey of N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide?
The InChIKey is UQDJUYUMGCQFMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-12(2)16(8-9-17)15(18)7-10-19-14-6-4-5-13(3)11-14/h4-6,11-12,17H,7-10H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide?
N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide has a molecular weight of 265.35 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-3-(3-methylphenoxy)-N-propan-2-ylpropanamide is sourced from PubChem (CID 43573145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).