N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide

C17H25NO3 — CID 63650924

IUPACN-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide
SMILESCc1ccc([C@H](C)O)c(OC(C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C17H25NO3/c1-11-8-9-15(12(2)19)16(10-11)21-13(3)17(20)18-14-6-4-5-7-14/h8-10,12-14,19H,4-7H2,1-3H3,(H,18,20)/t12-,13?/m0/s1
InChIKeyZDHWNLSJHRYPQI-UEWDXFNNSA-N
MW291.39 g/mol
LogP2.87
Rot. Bonds5

About N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide

N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide (PubChem CID 63650924) has the molecular formula C17H25NO3 and a molecular weight of 291.39 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide
PubChem CID63650924
Molecular FormulaC17H25NO3
Molecular Weight291.39 g/mol
Exact Mass291.18
IUPAC NameN-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide
SMILESCc1ccc([C@H](C)O)c(OC(C)C(=O)NC2CCCC2)c1
InChIInChI=1S/C17H25NO3/c1-11-8-9-15(12(2)19)16(10-11)21-13(3)17(20)18-14-6-4-5-7-14/h8-10,12-14,19H,4-7H2,1-3H3,(H,18,20)/t12-,13?/m0/s1
InChIKeyZDHWNLSJHRYPQI-UEWDXFNNSA-N
XLogP2.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(cyclopentylamino)-1-oxopropan-2-yl]oxy-4-methylbenzoic acid
CID 60651700
N-cyclooctyl-2-(2,3,5-trimethylphenoxy)propanamide
CID 46771023
2-[4-chloro-2-[(1S)-1-hydroxyethyl]phenoxy]-N-cyclopentylpropanamide
CID 78933522
N-cyclopentyl-2-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]acetamide
CID 63366475
N-cyclododecyl-2-(3-methylphenoxy)propanamide
CID 3912808
N-cyclooctyl-2-(3-methylphenoxy)propanamide
CID 2976571
N-cyclopentyl-2-[3-fluoro-4-(1-hydroxyethyl)phenoxy]propanamide
CID 107719756
(2S)-N-cyclooctyl-2-(2-methylphenoxy)propanamide
CID 94842700
(5-methyl-2-propan-2-ylphenyl) N-cyclohexylcarbamate
CID 134151064
2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]-N-(2-methoxyethyl)propanamide
CID 78946946
2-(2-chloro-5-methylphenoxy)-N-(1,1-dioxothian-4-yl)propanamide
CID 146122600
N-cyclopropyl-2-[2-(N-hydroxy-C-methylcarbonimidoyl)-5-methylphenoxy]propanamide
CID 77003528

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide?
The IUPAC name of N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide (CID 63650924) is N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide.
What is the SMILES notation for N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide?
The canonical SMILES for N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide is Cc1ccc([C@H](C)O)c(OC(C)C(=O)NC2CCCC2)c1.
What is the InChIKey of N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide?
The InChIKey is ZDHWNLSJHRYPQI-UEWDXFNNSA-N. The full InChI is InChI=1S/C17H25NO3/c1-11-8-9-15(12(2)19)16(10-11)21-13(3)17(20)18-14-6-4-5-7-14/h8-10,12-14,19H,4-7H2,1-3H3,(H,18,20)/t12-,13?/m0/s1.
What are the key properties of N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide?
N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide has a molecular weight of 291.39 g/mol, XLogP of 2.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-[(1S)-1-hydroxyethyl]-5-methylphenoxy]propanamide is sourced from PubChem (CID 63650924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).