N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide

C14H19NO3 — CID 55190758

IUPACN-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
SMILESC[C@H](O)c1ccc(OCCC(=O)NC2CC2)cc1
InChIInChI=1S/C14H19NO3/c1-10(16)11-2-6-13(7-3-11)18-9-8-14(17)15-12-4-5-12/h2-3,6-7,10,12,16H,4-5,8-9H2,1H3,(H,15,17)/t10-/m0/s1
InChIKeyRBZDJJNBKPFEPM-JTQLQIEISA-N
MW249.31 g/mol
LogP1.79
Rot. Bonds6

About N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide

N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide (PubChem CID 55190758) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
PubChem CID55190758
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC NameN-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
SMILESC[C@H](O)c1ccc(OCCC(=O)NC2CC2)cc1
InChIInChI=1S/C14H19NO3/c1-10(16)11-2-6-13(7-3-11)18-9-8-14(17)15-12-4-5-12/h2-3,6-7,10,12,16H,4-5,8-9H2,1H3,(H,15,17)/t10-/m0/s1
InChIKeyRBZDJJNBKPFEPM-JTQLQIEISA-N
XLogP1.79
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[3-(1-hydroxyethyl)phenoxy]propanamide
CID 62627215
3-(4-tert-butylphenoxy)-N-cyclopropylpropanamide
CID 60631425
N-ethyl-3-[4-[(1R)-1-hydroxyethyl]phenoxy]propanamide
CID 78930612
3-(4-propan-2-ylphenoxy)-N-pyrrolidin-3-ylpropanamide
CID 119450421
N-cyclohexyl-3-(4-methoxyphenoxy)propanamide
CID 974927
N-cyclopropyl-3-[[6-[(2-methylpropylamino)methyl]-3-pyridinyl]oxy]propanamide
CID 79788776
methyl 3-[4-[(1R)-1-hydroxyethyl]phenoxy]propanoate
CID 78955010
3-(4-chlorophenoxy)-N-cyclopentylpropanamide
CID 108790008
3-[3-[(1S)-1-aminoethyl]phenoxy]-N-cyclopropylpropanamide
CID 63367378
3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide
CID 78930528
N-cyclopropyl-3-[1-(4-ethoxyphenyl)ethylamino]propanamide
CID 79394735
4-[3-[(4-aminocyclohexyl)amino]-3-oxopropoxy]benzamide
CID 119476133

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide?
The IUPAC name of N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide (CID 55190758) is N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide?
The canonical SMILES for N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide is C[C@H](O)c1ccc(OCCC(=O)NC2CC2)cc1.
What is the InChIKey of N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide?
The InChIKey is RBZDJJNBKPFEPM-JTQLQIEISA-N. The full InChI is InChI=1S/C14H19NO3/c1-10(16)11-2-6-13(7-3-11)18-9-8-14(17)15-12-4-5-12/h2-3,6-7,10,12,16H,4-5,8-9H2,1H3,(H,15,17)/t10-/m0/s1.
What are the key properties of N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide?
N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide has a molecular weight of 249.31 g/mol, XLogP of 1.79, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[4-[(1S)-1-hydroxyethyl]phenoxy]propanamide is sourced from PubChem (CID 55190758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).