(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide

C17H21NO3 — CID 110901591

IUPAC(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCC(C)O)ccc2c1
InChIInChI=1S/C17H21NO3/c1-11(19)10-18-17(20)12(2)13-4-5-15-9-16(21-3)7-6-14(15)8-13/h4-9,11-12,19H,10H2,1-3H3,(H,18,20)/t11?,12-/m0/s1
InChIKeyJHZCGZLBPORKIY-KIYNQFGBSA-N
MW287.36 g/mol
LogP2.45
Rot. Bonds5

About (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide

(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide (PubChem CID 110901591) has the molecular formula C17H21NO3 and a molecular weight of 287.36 g/mol. Its IUPAC name is (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide.

Molecular Properties

Compound Name(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
PubChem CID110901591
Molecular FormulaC17H21NO3
Molecular Weight287.36 g/mol
Exact Mass287.15
IUPAC Name(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
SMILESCOc1ccc2cc([C@H](C)C(=O)NCC(C)O)ccc2c1
InChIInChI=1S/C17H21NO3/c1-11(19)10-18-17(20)12(2)13-4-5-15-9-16(21-3)7-6-14(15)8-13/h4-9,11-12,19H,10H2,1-3H3,(H,18,20)/t11?,12-/m0/s1
InChIKeyJHZCGZLBPORKIY-KIYNQFGBSA-N
XLogP2.45
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(6-methoxynaphthalen-2-yl)-N-[(2R)-2-phenylpropyl]propanamide
CID 9427304
(2S)-N-(2-methoxyethyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9207324
[2-(6-methoxynaphthalen-2-yl)propanoylamino]methyl methanesulfonate
CID 18682703
N-[2-(ethylamino)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 119505947
(2S)-N-hydroxy-2-(6-methoxynaphthalen-2-yl)propanamide
CID 92850098
disodium;(2S)-N-ethyl-2-(6-methoxynaphthalen-2-yl)propanamide;hydrogen phosphate
CID 70291925
N-[2-(4-ethoxyphenoxy)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 42917740
(2S)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 18161802
tert-butyl N-[6-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]hexyl]carbamate
CID 118612061
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(2S)-pentan-2-yl]propanamide
CID 95247403
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1S)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951625
(2R)-2-(6-methoxynaphthalen-2-yl)-N-[(1R)-1-(4-methoxyphenyl)propyl]propanamide
CID 39951624

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide?
The IUPAC name of (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide (CID 110901591) is (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide.
What is the SMILES notation for (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide?
The canonical SMILES for (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide is COc1ccc2cc([C@H](C)C(=O)NCC(C)O)ccc2c1.
What is the InChIKey of (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide?
The InChIKey is JHZCGZLBPORKIY-KIYNQFGBSA-N. The full InChI is InChI=1S/C17H21NO3/c1-11(19)10-18-17(20)12(2)13-4-5-15-9-16(21-3)7-6-14(15)8-13/h4-9,11-12,19H,10H2,1-3H3,(H,18,20)/t11?,12-/m0/s1.
What are the key properties of (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide?
(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide has a molecular weight of 287.36 g/mol, XLogP of 2.45, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide is sourced from PubChem (CID 110901591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).