N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide

C15H23NO3 — CID 115767199

IUPACN-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide
SMILESCCC(CCO)NC(=O)CCc1ccccc1OC
InChIInChI=1S/C15H23NO3/c1-3-13(10-11-17)16-15(18)9-8-12-6-4-5-7-14(12)19-2/h4-7,13,17H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyHUUNVILALOXJJQ-UHFFFAOYSA-N
MW265.35 g/mol
LogP1.90
Rot. Bonds8

About N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide

N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide (PubChem CID 115767199) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound NameN-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide
PubChem CID115767199
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC NameN-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide
SMILESCCC(CCO)NC(=O)CCc1ccccc1OC
InChIInChI=1S/C15H23NO3/c1-3-13(10-11-17)16-15(18)9-8-12-6-4-5-7-14(12)19-2/h4-7,13,17H,3,8-11H2,1-2H3,(H,16,18)
InChIKeyHUUNVILALOXJJQ-UHFFFAOYSA-N
XLogP1.90
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-[3-(2-methoxyphenyl)propanoylamino]pentanoate
CID 112533174
(2S)-2-[3-(2-methoxyphenyl)propanoylamino]-3-methylpentanoic acid
CID 61172911
1-(1-hydroxypentan-3-yl)-3-[2-(2-methoxyphenyl)propyl]urea
CID 111455135
3-(2-aminophenyl)-N-(4-hydroxy-1-methoxybutan-2-yl)propanamide
CID 106161001
3-(2-methoxyphenyl)-N-sulfanylpropanamide
CID 134582208
3-[[3-(2-methoxyphenyl)propanoylamino]methyl]pentanoic acid
CID 81066007
N-(4-hydroxybutyl)-3-(2-methoxyphenyl)propanamide
CID 106843312
N-(2,6-diethylphenyl)-3-(2-methoxyphenyl)propanamide
CID 51143891
N-(2,3-dihydroxypropyl)-3-(2-methoxyphenyl)propanamide
CID 66175795
4-amino-2-[3-(2-methoxyphenyl)propanoylamino]-4-oxobutanoic acid
CID 43240218
3-(2-methoxyphenyl)-N-phenylpropanamide
CID 7732837
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide?
The IUPAC name of N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide (CID 115767199) is N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide.
What is the SMILES notation for N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide?
The canonical SMILES for N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide is CCC(CCO)NC(=O)CCc1ccccc1OC.
What is the InChIKey of N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide?
The InChIKey is HUUNVILALOXJJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-3-13(10-11-17)16-15(18)9-8-12-6-4-5-7-14(12)19-2/h4-7,13,17H,3,8-11H2,1-2H3,(H,16,18).
What are the key properties of N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide?
N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide has a molecular weight of 265.35 g/mol, XLogP of 1.90, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypentan-3-yl)-3-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 115767199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).