(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide

C21H28N2O3 — CID 95247391

IUPAC(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide
SMILESCOc1ccc2cc([C@@H](C)C(=O)NCCCN3CCOCC3)ccc2c1
InChIInChI=1S/C21H28N2O3/c1-16(21(24)22-8-3-9-23-10-12-26-13-11-23)17-4-5-19-15-20(25-2)7-6-18(19)14-17/h4-7,14-16H,3,8-13H2,1-2H3,(H,22,24)/t16-/m1/s1
InChIKeyHLQYTUWUISVJGU-MRXNPFEDSA-N
MW356.47 g/mol
LogP2.79
Rot. Bonds7

About (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide

(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide (PubChem CID 95247391) has the molecular formula C21H28N2O3 and a molecular weight of 356.47 g/mol. Its IUPAC name is (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide
PubChem CID95247391
Molecular FormulaC21H28N2O3
Molecular Weight356.47 g/mol
Exact Mass356.21
IUPAC Name(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide
SMILESCOc1ccc2cc([C@@H](C)C(=O)NCCCN3CCOCC3)ccc2c1
InChIInChI=1S/C21H28N2O3/c1-16(21(24)22-8-3-9-23-10-12-26-13-11-23)17-4-5-19-15-20(25-2)7-6-18(19)14-17/h4-7,14-16H,3,8-13H2,1-2H3,(H,22,24)/t16-/m1/s1
InChIKeyHLQYTUWUISVJGU-MRXNPFEDSA-N
XLogP2.79
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-[1-(4-methoxyphenyl)ethyl]-N-(3-morpholin-4-ylpropyl)oxamide
CID 108510277
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]propanamide
CID 55941741
N-(3-ethyl-2-morpholin-4-ylpentyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 42943249
(2S)-N-[(2S)-3-ethyl-2-morpholin-4-ylpentyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 25495550
(2S)-2-(6-methoxynaphthalen-2-yl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]propanamide
CID 18150680
2-(4-methoxyphenyl)-3-methyl-N-(2-morpholin-4-ylethyl)butanamide
CID 110316912
1-[(1S)-1-(2,4-dimethoxyphenyl)ethyl]-1-methyl-3-(3-morpholin-4-ylpropyl)urea
CID 126452003
(2S)-N-(2-methoxyethyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 9207324
tert-butyl N-[6-[[(2S)-2-(6-methoxynaphthalen-2-yl)propanoyl]amino]hexyl]carbamate
CID 118612061
(2S)-N-(2-hydroxypropyl)-2-(6-methoxynaphthalen-2-yl)propanamide
CID 110901591
2-amino-4-methoxy-N-(3-morpholin-4-ylpropyl)benzamide
CID 80503310
N-[2-(ethylamino)ethyl]-2-(6-methoxynaphthalen-2-yl)propanamide
CID 119505947

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide?
The IUPAC name of (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide (CID 95247391) is (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide.
What is the SMILES notation for (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide?
The canonical SMILES for (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide is COc1ccc2cc([C@@H](C)C(=O)NCCCN3CCOCC3)ccc2c1.
What is the InChIKey of (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide?
The InChIKey is HLQYTUWUISVJGU-MRXNPFEDSA-N. The full InChI is InChI=1S/C21H28N2O3/c1-16(21(24)22-8-3-9-23-10-12-26-13-11-23)17-4-5-19-15-20(25-2)7-6-18(19)14-17/h4-7,14-16H,3,8-13H2,1-2H3,(H,22,24)/t16-/m1/s1.
What are the key properties of (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide?
(2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide has a molecular weight of 356.47 g/mol, XLogP of 2.79, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(6-methoxynaphthalen-2-yl)-N-(3-morpholin-4-ylpropyl)propanamide is sourced from PubChem (CID 95247391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).