N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide

C15H17NO3 — CID 70248238

IUPACN,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide
SMILESCCN(CC)C(=O)c1cc2cccc(O)c2cc1O
InChIInChI=1S/C15H17NO3/c1-3-16(4-2)15(19)12-8-10-6-5-7-13(17)11(10)9-14(12)18/h5-9,17-18H,3-4H2,1-2H3
InChIKeyWUUNYSHNKVDPGL-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.73
Rot. Bonds3

About N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide

N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide (PubChem CID 70248238) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide
PubChem CID70248238
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC NameN,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide
SMILESCCN(CC)C(=O)c1cc2cccc(O)c2cc1O
InChIInChI=1S/C15H17NO3/c1-3-16(4-2)15(19)12-8-10-6-5-7-13(17)11(10)9-14(12)18/h5-9,17-18H,3-4H2,1-2H3
InChIKeyWUUNYSHNKVDPGL-UHFFFAOYSA-N
XLogP2.73
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-5-hydroxynaphthalene-2-carboxamide
CID 172677597
N,N-diethyl-2,3-dihydroxybenzamide
CID 15178612
N,N-diethyl-2-(naphthalen-1-ylamino)benzamide
CID 86200085
2-methylpropyl 3,5-dihydroxynaphthalene-2-carboxylate
CID 18787642
N-ethyl-3-hydroxy-2-methyl-N-(2-methylpropyl)benzamide
CID 82830028
N,N-diethyl-8-methoxy-2-oxochromene-3-carboxamide
CID 807442
N,N-diethylisoquinoline-5-carboxamide
CID 86202974
N,N-diethylphenanthrene-2-carboxamide
CID 15466572
N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide
CID 60654196
3-chloro-N,N-diethyl-2-hydroxybenzamide
CID 68591956
3-hydroxy-N-methyl-N-propylnaphthalene-2-carboxamide
CID 43624990
4-[2-[6-[1-[3-(diethylcarbamoyl)-2-hydroxynaphthalen-1-yl]naphthalen-2-yl]oxyhexoxy]naphthalen-1-yl]-N,N-diethyl-3-hydroxynaphthalene-2-carboxamide;zinc
CID 10581625

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide?
The IUPAC name of N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide (CID 70248238) is N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide?
The canonical SMILES for N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide is CCN(CC)C(=O)c1cc2cccc(O)c2cc1O.
What is the InChIKey of N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide?
The InChIKey is WUUNYSHNKVDPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-3-16(4-2)15(19)12-8-10-6-5-7-13(17)11(10)9-14(12)18/h5-9,17-18H,3-4H2,1-2H3.
What are the key properties of N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide?
N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide has a molecular weight of 259.31 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3,5-dihydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 70248238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).