6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde

C19H20O3 — CID 88671274

IUPAC6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
SMILESCOc1ccc(C2CCc3cc(OC)ccc3C2C=O)cc1
InChIInChI=1S/C19H20O3/c1-21-15-6-3-13(4-7-15)17-9-5-14-11-16(22-2)8-10-18(14)19(17)12-20/h3-4,6-8,10-12,17,19H,5,9H2,1-2H3
InChIKeyKLIKOAMTUFKUKP-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.72
Rot. Bonds4

About 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde

6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde (PubChem CID 88671274) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde.

Molecular Properties

Compound Name6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
PubChem CID88671274
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Name6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
SMILESCOc1ccc(C2CCc3cc(OC)ccc3C2C=O)cc1
InChIInChI=1S/C19H20O3/c1-21-15-6-3-13(4-7-15)17-9-5-14-11-16(22-2)8-10-18(14)19(17)12-20/h3-4,6-8,10-12,17,19H,5,9H2,1-2H3
InChIKeyKLIKOAMTUFKUKP-UHFFFAOYSA-N
XLogP3.72
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde 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

(1S,2R)-2-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol
CID 125482572
6-methoxy-2a,3,4,8b-tetrahydro-1H-naphtho[1,2-b]azet-2-one
CID 66350309
(E)-N,N-diethyl-3-[4-[6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]phenyl]prop-2-enamide
CID 70149469
3-ethyl-6-methoxy-2-phenyl-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde
CID 142686311
2-[6-methoxy-2-(2-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]acetaldehyde
CID 19830754
3-methoxy-17-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthrene
CID 14583318
7-methoxy-2,3,4,5-tetrahydro-1H-2-benzazepine-1-carbaldehyde
CID 175293128
2-[4-[5-[6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pentyl]phenyl]acetic acid
CID 19830764
6-methoxy-1,2,3,4-tetrahydroquinoline-2-carbaldehyde
CID 140970249
2-[4-[5-[6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalen-1-yl]pentyl]phenyl]ethanol
CID 70448004
(8R,9S,13S)-3-methoxy-13-methyl-7,8,9,11,12,16-hexahydro-6H-cyclopenta[a]phenanthren-17-one
CID 10869758
(1S)-5-methoxy-2,3-dihydro-1H-indene-1-carbonitrile
CID 86319053

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde?
The IUPAC name of 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde (CID 88671274) is 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde.
What is the SMILES notation for 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde?
The canonical SMILES for 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde is COc1ccc(C2CCc3cc(OC)ccc3C2C=O)cc1.
What is the InChIKey of 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde?
The InChIKey is KLIKOAMTUFKUKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c1-21-15-6-3-13(4-7-15)17-9-5-14-11-16(22-2)8-10-18(14)19(17)12-20/h3-4,6-8,10-12,17,19H,5,9H2,1-2H3.
What are the key properties of 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde?
6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde has a molecular weight of 296.37 g/mol, XLogP of 3.72, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydronaphthalene-1-carbaldehyde is sourced from PubChem (CID 88671274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).