ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide

C20H27N3O2 — CID 142853852

IUPACethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide
SMILESCC.CC.COc1ccc2c(-c3cnc(NC(C)=O)[nH]3)cccc2c1
InChIInChI=1S/C16H15N3O2.2C2H6/c1-10(20)18-16-17-9-15(19-16)14-5-3-4-11-8-12(21-2)6-7-13(11)14;2*1-2/h3-9H,1-2H3,(H2,17,18,19,20);2*1-2H3
InChIKeyWFULXCYKTODPOI-UHFFFAOYSA-N
MW341.46 g/mol
LogP5.25
Rot. Bonds3

About ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide

ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide (PubChem CID 142853852) has the molecular formula C20H27N3O2 and a molecular weight of 341.46 g/mol. Its IUPAC name is ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide.

Molecular Properties

Compound Nameethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide
PubChem CID142853852
Molecular FormulaC20H27N3O2
Molecular Weight341.46 g/mol
Exact Mass341.21
IUPAC Nameethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide
SMILESCC.CC.COc1ccc2c(-c3cnc(NC(C)=O)[nH]3)cccc2c1
InChIInChI=1S/C16H15N3O2.2C2H6/c1-10(20)18-16-17-9-15(19-16)14-5-3-4-11-8-12(21-2)6-7-13(11)14;2*1-2/h3-9H,1-2H3,(H2,17,18,19,20);2*1-2H3
InChIKeyWFULXCYKTODPOI-UHFFFAOYSA-N
XLogP5.25
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.46
LogP ≤ 55.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-1-(6-methoxynaphthalen-1-yl)ethanone;ethanol;guanidine;5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-amine;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide
CID 167712617
N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]-15-methyltetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15-carboxamide
CID 10368117
N-[5-(6-chloro-2-pyridinyl)-1H-imidazol-2-yl]acetamide
CID 170341058
N-[2-(5-methoxy-1H-indol-2-yl)phenyl]acetamide
CID 10731437
(6-methoxynaphthalen-1-yl) acetate
CID 11424471
6-methoxy-2-naphthalen-1-yl-1H-1,8-naphthyridin-4-one
CID 159730882
2-(6-methoxynaphthalen-1-yl)acetic acid
CID 10398394
tert-butyl N-(6-methoxynaphthalen-1-yl)carbamate
CID 12843045
N-(2-benzyl-8-methoxybenzo[f]quinoxalin-3-yl)acetamide
CID 70662806
2-(5-acetamidonaphthalen-2-yl)-4-methoxybenzoic acid
CID 154189489
N-[2-(6-methoxy-1H-benzimidazol-2-yl)phenyl]acetamide
CID 18984570
4,7-dimethoxyisoquinoline-3-carboxylic acid
CID 22923779

Frequently Asked Questions

What is the IUPAC name of ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide?
The IUPAC name of ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide (CID 142853852) is ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide.
What is the SMILES notation for ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide?
The canonical SMILES for ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide is CC.CC.COc1ccc2c(-c3cnc(NC(C)=O)[nH]3)cccc2c1.
What is the InChIKey of ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide?
The InChIKey is WFULXCYKTODPOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O2.2C2H6/c1-10(20)18-16-17-9-15(19-16)14-5-3-4-11-8-12(21-2)6-7-13(11)14;2*1-2/h3-9H,1-2H3,(H2,17,18,19,20);2*1-2H3.
What are the key properties of ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide?
ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide has a molecular weight of 341.46 g/mol, XLogP of 5.25, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-[5-(6-methoxynaphthalen-1-yl)-1H-imidazol-2-yl]acetamide is sourced from PubChem (CID 142853852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).