N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide

C22H24N2O4 — CID 166219863

IUPACN-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(O)c3ccccc3c2)cc1OCCN(C)C
InChIInChI=1S/C22H24N2O4/c1-24(2)10-11-28-21-14-17(8-9-20(21)27-3)23-22(26)16-12-15-6-4-5-7-18(15)19(25)13-16/h4-9,12-14,25H,10-11H2,1-3H3,(H,23,26)
InChIKeyWVWRHRGPRIXIQZ-UHFFFAOYSA-N
MW380.44 g/mol
LogP3.75
Rot. Bonds7

About N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide

N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide (PubChem CID 166219863) has the molecular formula C22H24N2O4 and a molecular weight of 380.44 g/mol. Its IUPAC name is N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide
PubChem CID166219863
Molecular FormulaC22H24N2O4
Molecular Weight380.44 g/mol
Exact Mass380.17
IUPAC NameN-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cc(O)c3ccccc3c2)cc1OCCN(C)C
InChIInChI=1S/C22H24N2O4/c1-24(2)10-11-28-21-14-17(8-9-20(21)27-3)23-22(26)16-12-15-6-4-5-7-18(15)19(25)13-16/h4-9,12-14,25H,10-11H2,1-3H3,(H,23,26)
InChIKeyWVWRHRGPRIXIQZ-UHFFFAOYSA-N
XLogP3.75
TPSA71.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.44
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 4-[2-[[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]carbamoyl]phenyl]-3-methylbenzoate
CID 18980122
2,6-dichloro-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]pyridine-4-carboxamide
CID 86930838
2,6-dichloro-N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]pyridine-4-carboxamide
CID 86964022
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-(3-nitrophenyl)benzamide
CID 18672595
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-2-(4-phenylphenyl)acetamide
CID 139912017
N-[3-[2-(diethylamino)ethoxy]-4-methoxyphenyl]-4-phenylbenzamide
CID 56988348
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-[4-[(E)-N-methoxy-C-methylcarbonimidoyl]-2-methylphenyl]benzamide
CID 23204979
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-4-(3-hydroxyphenyl)benzamide
CID 18672596
1-(3-ethoxy-4-methoxyphenyl)-3-(4-methoxynaphthalen-2-yl)urea
CID 166327902
N-[3-[2-[di(propan-2-yl)amino]ethoxy]-4-methoxyphenyl]-6-phenylpyridine-3-carboxamide
CID 22459286
N-[6-[7-[2-(dimethylamino)ethoxy]-6-methoxyquinolin-4-yl]oxynaphthalen-2-yl]benzamide;ethane;molecular hydrogen
CID 143083731
N-(3,4-dimethoxyphenyl)-4-(2-phenoxyethoxy)benzamide
CID 54781369

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide?
The IUPAC name of N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide (CID 166219863) is N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide.
What is the SMILES notation for N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide?
The canonical SMILES for N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide is COc1ccc(NC(=O)c2cc(O)c3ccccc3c2)cc1OCCN(C)C.
What is the InChIKey of N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide?
The InChIKey is WVWRHRGPRIXIQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O4/c1-24(2)10-11-28-21-14-17(8-9-20(21)27-3)23-22(26)16-12-15-6-4-5-7-18(15)19(25)13-16/h4-9,12-14,25H,10-11H2,1-3H3,(H,23,26).
What are the key properties of N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide?
N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide has a molecular weight of 380.44 g/mol, XLogP of 3.75, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(dimethylamino)ethoxy]-4-methoxyphenyl]-4-hydroxynaphthalene-2-carboxamide is sourced from PubChem (CID 166219863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).