2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide

C18H23NO3 — CID 101334019

IUPAC2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide
SMILESCOc1cccc2ccc(O)c(C(=O)N(C(C)C)C(C)C)c12
InChIInChI=1S/C18H23NO3/c1-11(2)19(12(3)4)18(21)17-14(20)10-9-13-7-6-8-15(22-5)16(13)17/h6-12,20H,1-5H3
InChIKeyWXGAUTMROJXLCU-UHFFFAOYSA-N
MW301.39 g/mol
LogP3.81
Rot. Bonds4

About 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide

2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide (PubChem CID 101334019) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide.

Molecular Properties

Compound Name2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide
PubChem CID101334019
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC Name2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide
SMILESCOc1cccc2ccc(O)c(C(=O)N(C(C)C)C(C)C)c12
InChIInChI=1S/C18H23NO3/c1-11(2)19(12(3)4)18(21)17-14(20)10-9-13-7-6-8-15(22-5)16(13)17/h6-12,20H,1-5H3
InChIKeyWXGAUTMROJXLCU-UHFFFAOYSA-N
XLogP3.81
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-isoquinolin-4-yl-6-methoxy-N,N-di(propan-2-yl)benzamide
CID 39781804
2-methoxy-6-(4-methoxynaphthalen-2-yl)-N,N-di(propan-2-yl)benzamide
CID 18692667
2-fluoro-3-iodo-6-methoxy-N,N-di(propan-2-yl)benzamide
CID 146670025
(2S,3S)-1-(2,6-dimethoxyphenyl)-3-hydroxy-2-methylbutan-1-one
CID 102019504
8-methoxynaphthalene-1-carbonyl chloride
CID 14175958
8-methoxy-1-methylnaphthalene-2-carboxylic acid
CID 115057552
2-methyl-N,N-di(propan-2-yl)naphthalene-1-carboxamide
CID 15828026
2,4-dimethoxy-N,N-di(propan-2-yl)benzamide
CID 801007
2-(benzenesulfonylmethyl)-8-methoxynaphthalene-1-carboxylic acid
CID 52913419
1,2,4,5-tetramethoxyphenanthrene-3-carboxylic acid
CID 174558814
2-[(2,6-dimethoxybenzoyl)-methylamino]propanoic acid
CID 55098642
methyl 2-(benzenesulfonylmethyl)-8-methoxynaphthalene-1-carboxylate
CID 67107686

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The IUPAC name of 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide (CID 101334019) is 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide.
What is the SMILES notation for 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The canonical SMILES for 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide is COc1cccc2ccc(O)c(C(=O)N(C(C)C)C(C)C)c12.
What is the InChIKey of 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
The InChIKey is WXGAUTMROJXLCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-11(2)19(12(3)4)18(21)17-14(20)10-9-13-7-6-8-15(22-5)16(13)17/h6-12,20H,1-5H3.
What are the key properties of 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide?
2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-8-methoxy-N,N-di(propan-2-yl)naphthalene-1-carboxamide is sourced from PubChem (CID 101334019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).