N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide

C14H14BrNO — CID 68760589

IUPACN-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C14H14BrNO/c1-9(16-10(2)17)11-3-4-13-8-14(15)6-5-12(13)7-11/h3-9H,1-2H3,(H,16,17)
InChIKeyNRZOWBGSUJTDEV-UHFFFAOYSA-N
MW292.18 g/mol
LogP3.80
Rot. Bonds2

About N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide

N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide (PubChem CID 68760589) has the molecular formula C14H14BrNO and a molecular weight of 292.18 g/mol. Its IUPAC name is N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide
PubChem CID68760589
Molecular FormulaC14H14BrNO
Molecular Weight292.18 g/mol
Exact Mass291.03
IUPAC NameN-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide
SMILESCC(=O)NC(C)c1ccc2cc(Br)ccc2c1
InChIInChI=1S/C14H14BrNO/c1-9(16-10(2)17)11-3-4-13-8-14(15)6-5-12(13)7-11/h3-9H,1-2H3,(H,16,17)
InChIKeyNRZOWBGSUJTDEV-UHFFFAOYSA-N
XLogP3.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.18
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-bromo-N-[(1R)-1-(3,4-dimethylphenyl)ethyl]naphthalene-2-carboxamide
CID 67105818
methyl 2-(6-bromonaphthalen-2-yl)propanoate
CID 154165948
(2S)-2-(6-bromonaphthalen-2-yl)oxy-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 7786780
N-[1-(3-bromo-4-methoxyphenyl)ethyl]acetamide
CID 47119084
N-[1-[6-(3-methoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
CID 68761728
4-(1-acetamidoethyl)-2-methylbenzoic acid
CID 66897656
(2S)-2-acetamido-N-[(1R)-1-(3-bromophenyl)ethyl]propanamide
CID 94823421
3-(6-bromonaphthalen-2-yl)oxybutan-2-one
CID 60624745
N-[1-[6-(3-ethoxyphenoxy)naphthalen-2-yl]ethyl]acetamide
CID 68759728
2-(6-bromonaphthalen-2-yl)oxy-N-propan-2-ylpropanamide
CID 60517133
(S)-N-[(1R)-1-(7-bromonaphthalen-2-yl)ethyl]-2-methylpropane-2-sulfinamide
CID 118582712
2-(5-bromo-2-oxo-1-pyridinyl)-N-(1-naphthalen-2-ylethyl)acetamide
CID 17464666

Frequently Asked Questions

What is the IUPAC name of N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide?
The IUPAC name of N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide (CID 68760589) is N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide.
What is the SMILES notation for N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide?
The canonical SMILES for N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide is CC(=O)NC(C)c1ccc2cc(Br)ccc2c1.
What is the InChIKey of N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide?
The InChIKey is NRZOWBGSUJTDEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO/c1-9(16-10(2)17)11-3-4-13-8-14(15)6-5-12(13)7-11/h3-9H,1-2H3,(H,16,17).
What are the key properties of N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide?
N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide has a molecular weight of 292.18 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-bromonaphthalen-2-yl)ethyl]acetamide is sourced from PubChem (CID 68760589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).