3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide

C22H17NO3 — CID 101061990

IUPAC3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide
SMILESCNC(=O)c1cc2ccccc2c(-c2c(O)ccc3ccccc23)c1O
InChIInChI=1S/C22H17NO3/c1-23-22(26)17-12-14-7-3-5-9-16(14)20(21(17)25)19-15-8-4-2-6-13(15)10-11-18(19)24/h2-12,24-25H,1H3,(H,23,26)
InChIKeyMPFDERNSEPUBNY-UHFFFAOYSA-N
MW343.38 g/mol
LogP4.43
Rot. Bonds2

About 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide

3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide (PubChem CID 101061990) has the molecular formula C22H17NO3 and a molecular weight of 343.38 g/mol. Its IUPAC name is 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide
PubChem CID101061990
Molecular FormulaC22H17NO3
Molecular Weight343.38 g/mol
Exact Mass343.12
IUPAC Name3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide
SMILESCNC(=O)c1cc2ccccc2c(-c2c(O)ccc3ccccc23)c1O
InChIInChI=1S/C22H17NO3/c1-23-22(26)17-12-14-7-3-5-9-16(14)20(21(17)25)19-15-8-4-2-6-13(15)10-11-18(19)24/h2-12,24-25H,1H3,(H,23,26)
InChIKeyMPFDERNSEPUBNY-UHFFFAOYSA-N
XLogP4.43
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 54.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalene-2-carboxylic acid
CID 160574931
[3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]-(4-methylphenyl)methanone
CID 18720381
4-formyl-3-hydroxy-N-methylnaphthalene-2-carboxamide
CID 54318680
3-hydroxy-4-[2-(methylamino)naphthalen-1-yl]naphthalene-2-carboxylic acid
CID 11810055
methyl 3-hydroxy-4-(2-hydroxy-3-methoxycarbonylnaphthalen-1-yl)naphthalene-2-carboxylate
CID 10905491
3-carboxy-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-olate
CID 54721974
3-bromo-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 101402327
dizinc;4-(3-carboxy-2-hydroxynaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylic acid
CID 161380259
methyl 4-(2-aminonaphthalen-1-yl)-3-hydroxynaphthalene-2-carboxylate
CID 10427547
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
3-[3-[3-hydroxy-4-(2-hydroxynaphthalen-1-yl)naphthalen-2-yl]propyl]-1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
CID 101021854
1-(2-hydroxynaphthalen-1-yl)naphthalene-2-carboxamide
CID 101266046

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide?
The IUPAC name of 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide (CID 101061990) is 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide.
What is the SMILES notation for 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide?
The canonical SMILES for 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide is CNC(=O)c1cc2ccccc2c(-c2c(O)ccc3ccccc23)c1O.
What is the InChIKey of 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide?
The InChIKey is MPFDERNSEPUBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3/c1-23-22(26)17-12-14-7-3-5-9-16(14)20(21(17)25)19-15-8-4-2-6-13(15)10-11-18(19)24/h2-12,24-25H,1H3,(H,23,26).
What are the key properties of 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide?
3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 4.43, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-4-(2-hydroxynaphthalen-1-yl)-N-methylnaphthalene-2-carboxamide is sourced from PubChem (CID 101061990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).