N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide

C14H15NO2 — CID 170421531

IUPACN-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cccc2cc(O)ccc12
InChIInChI=1S/C14H15NO2/c1-9(2)14(17)15-13-5-3-4-10-8-11(16)6-7-12(10)13/h3-9,16H,1-2H3,(H,15,17)
InChIKeyARSABUGDKNKSOW-UHFFFAOYSA-N
MW229.28 g/mol
LogP3.14
Rot. Bonds2

About N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide

N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide (PubChem CID 170421531) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide
PubChem CID170421531
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC NameN-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1cccc2cc(O)ccc12
InChIInChI=1S/C14H15NO2/c1-9(2)14(17)15-13-5-3-4-10-8-11(16)6-7-12(10)13/h3-9,16H,1-2H3,(H,15,17)
InChIKeyARSABUGDKNKSOW-UHFFFAOYSA-N
XLogP3.14
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-(6-nitronaphthalen-1-yl)propanamide
CID 163232974
ethane;5-(2-methylpropanoylamino)naphthalene-2-sulfonic acid
CID 163232972
2-amino-N-(7-hydroxynaphthalen-1-yl)propanamide
CID 18475864
5-(methylamino)naphthalen-2-ol
CID 74890550
1-(6-hydroxynaphthalen-1-yl)-3-naphthalen-2-ylurea
CID 91060621
(6-hydroxynaphthalen-1-yl)thiourea
CID 28689410
3-[(6-hydroxynaphthalen-1-yl)carbamoylamino]-N-methylbenzamide
CID 91416891
dimethyl (E)-2-[(6-hydroxynaphthalen-1-yl)amino]but-2-enedioate
CID 168566197
N-(2-amino-4-hydroxyphenyl)-2-methylpropanamide
CID 107697096
N-(8-hydroxy-6-methylnaphthalen-1-yl)-2-methylpropanamide
CID 170421492
naphthalen-1-ylmethyl 2-(2-methylpropanoylamino)benzoate
CID 926085
5-propan-2-ylnaphthalen-2-ol
CID 19011144

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide?
The IUPAC name of N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide (CID 170421531) is N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide.
What is the SMILES notation for N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide?
The canonical SMILES for N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide is CC(C)C(=O)Nc1cccc2cc(O)ccc12.
What is the InChIKey of N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide?
The InChIKey is ARSABUGDKNKSOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-9(2)14(17)15-13-5-3-4-10-8-11(16)6-7-12(10)13/h3-9,16H,1-2H3,(H,15,17).
What are the key properties of N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide?
N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide has a molecular weight of 229.28 g/mol, XLogP of 3.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxynaphthalen-1-yl)-2-methylpropanamide is sourced from PubChem (CID 170421531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).