5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide

C14H15NO3 — CID 118414497

IUPAC5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide
SMILESCC(C)Oc1cc2c(O)cccc2cc1C(N)=O
InChIInChI=1S/C14H15NO3/c1-8(2)18-13-7-10-9(4-3-5-12(10)16)6-11(13)14(15)17/h3-8,16H,1-2H3,(H2,15,17)
InChIKeyBARXLWCHWRCNLA-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.43
Rot. Bonds3

About 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide

5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide (PubChem CID 118414497) has the molecular formula C14H15NO3 and a molecular weight of 245.28 g/mol. Its IUPAC name is 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide
PubChem CID118414497
Molecular FormulaC14H15NO3
Molecular Weight245.28 g/mol
Exact Mass245.11
IUPAC Name5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide
SMILESCC(C)Oc1cc2c(O)cccc2cc1C(N)=O
InChIInChI=1S/C14H15NO3/c1-8(2)18-13-7-10-9(4-3-5-12(10)16)6-11(13)14(15)17/h3-8,16H,1-2H3,(H2,15,17)
InChIKeyBARXLWCHWRCNLA-UHFFFAOYSA-N
XLogP2.43
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methoxy-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 126639424
4-amino-2-propan-2-yloxybenzamide
CID 53495725
2-methylpropyl 3,5-dihydroxynaphthalene-2-carboxylate
CID 18787642
5-bromo-2-propan-2-yloxybenzamide
CID 17052192
1-[[(1R,4S,5S)-2-azabicyclo[2.2.1]heptan-5-yl]oxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 118414363
5-fluoro-4-methyl-2-propan-2-yloxybenzamide
CID 59113922
1-[6,7-di(propan-2-yloxy)naphthalen-1-yl]-6,7-di(propan-2-yloxy)naphthalene
CID 162469481
1-[[(3S)-oxolan-3-yl]methoxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 125495422
1-[[(2S,4R)-4-methyl-5-oxopyrrolidin-2-yl]methoxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 118414884
1-[[(2S,4S)-4-methyl-5-oxopyrrolidin-2-yl]methoxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 118414742
1-[2-[(2S)-5-oxopyrrolidin-2-yl]ethoxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 134214180
1-[[(2R)-2-methyl-5-oxopyrrolidin-2-yl]methoxy]-7-propan-2-yloxyisoquinoline-6-carboxamide
CID 118414316

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide?
The IUPAC name of 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide (CID 118414497) is 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide.
What is the SMILES notation for 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide?
The canonical SMILES for 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide is CC(C)Oc1cc2c(O)cccc2cc1C(N)=O.
What is the InChIKey of 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide?
The InChIKey is BARXLWCHWRCNLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO3/c1-8(2)18-13-7-10-9(4-3-5-12(10)16)6-11(13)14(15)17/h3-8,16H,1-2H3,(H2,15,17).
What are the key properties of 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide?
5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-3-propan-2-yloxynaphthalene-2-carboxamide is sourced from PubChem (CID 118414497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).