N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide

C15H23NO3 — CID 78933960

IUPACN-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide
SMILESCC(Oc1cccc([C@@H](C)O)c1)C(=O)NC(C)(C)C
InChIInChI=1S/C15H23NO3/c1-10(17)12-7-6-8-13(9-12)19-11(2)14(18)16-15(3,4)5/h6-11,17H,1-5H3,(H,16,18)/t10-,11?/m1/s1
InChIKeyIFRNHKGYKBTGDP-NFJWQWPMSA-N
MW265.35 g/mol
LogP2.42
Rot. Bonds4

About N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide

N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide (PubChem CID 78933960) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide
PubChem CID78933960
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide
SMILESCC(Oc1cccc([C@@H](C)O)c1)C(=O)NC(C)(C)C
InChIInChI=1S/C15H23NO3/c1-10(17)12-7-6-8-13(9-12)19-11(2)14(18)16-15(3,4)5/h6-11,17H,1-5H3,(H,16,18)/t10-,11?/m1/s1
InChIKeyIFRNHKGYKBTGDP-NFJWQWPMSA-N
XLogP2.42
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]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

(2S)-N-tert-butyl-2-(3-chlorophenoxy)propanamide
CID 966263
N-carbamoyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide
CID 63365371
2-[3-(1-hydroxyethyl)phenoxy]-N-prop-2-ynylpropanamide
CID 43504220
N-butyl-2-[3-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 55190064
(1S)-1-(3-propan-2-yloxyphenyl)ethanol
CID 75358098
(2S)-N-tert-butyl-2-(4-methoxyphenoxy)propanamide
CID 925163
2-[4-[(1S)-1-aminoethyl]phenoxy]-N-tert-butylpropanamide
CID 78933085
N-(1-amino-2,3-dimethylbutan-2-yl)-2-(3-propan-2-ylphenoxy)propanamide;hydrochloride
CID 119606053
N-tert-butyl-2-[1-(3-methoxyphenyl)ethylamino]propanamide
CID 115588995
methyl 2-methyl-2-[2-(3-propan-2-ylphenoxy)propanoylamino]pentanoate
CID 55793330
(2R)-2-(3-chlorophenoxy)-N-[3-[(1S)-1-hydroxyethyl]phenyl]propanamide
CID 9497360
N-tert-butyl-2-(4-formylphenoxy)propanamide
CID 43086480

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide?
The IUPAC name of N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide (CID 78933960) is N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide.
What is the SMILES notation for N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide?
The canonical SMILES for N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide is CC(Oc1cccc([C@@H](C)O)c1)C(=O)NC(C)(C)C.
What is the InChIKey of N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide?
The InChIKey is IFRNHKGYKBTGDP-NFJWQWPMSA-N. The full InChI is InChI=1S/C15H23NO3/c1-10(17)12-7-6-8-13(9-12)19-11(2)14(18)16-15(3,4)5/h6-11,17H,1-5H3,(H,16,18)/t10-,11?/m1/s1.
What are the key properties of N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide?
N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide has a molecular weight of 265.35 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[3-[(1R)-1-hydroxyethyl]phenoxy]propanamide is sourced from PubChem (CID 78933960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).