(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene

C17H24O2 — CID 14864209

IUPAC(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESC=C(C)[C@H]1CC[C@H](C)c2c1cc(C)c(OC)c2OC
InChIInChI=1S/C17H24O2/c1-10(2)13-8-7-11(3)15-14(13)9-12(4)16(18-5)17(15)19-6/h9,11,13H,1,7-8H2,2-6H3/t11-,13+/m0/s1
InChIKeySDRDCRWQVIPPTL-WCQYABFASA-N
MW260.38 g/mol
LogP4.57
Rot. Bonds3

About (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene

(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene (PubChem CID 14864209) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene
PubChem CID14864209
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene
SMILESC=C(C)[C@H]1CC[C@H](C)c2c1cc(C)c(OC)c2OC
InChIInChI=1S/C17H24O2/c1-10(2)13-8-7-11(3)15-14(13)9-12(4)16(18-5)17(15)19-6/h9,11,13H,1,7-8H2,2-6H3/t11-,13+/m0/s1
InChIKeySDRDCRWQVIPPTL-WCQYABFASA-N
XLogP4.57
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene 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

(4S)-6-methoxy-4,7-dimethyl-1-(6-methylhepta-3,5-dien-2-yl)-5-phenylmethoxy-1,2,3,4-tetrahydronaphthalene
CID 91586402
(4S,7S)-7-methyl-4-prop-1-en-2-yl-4,5,6,7-tetrahydro-1H-indazole
CID 101431968
carbon monoxide;chromium;(1S,4E)-4-ethylidene-7,8-dimethoxy-1,6-dimethyl-2,3-dihydro-1H-naphthalene
CID 11773467
7,8-dimethoxy-4,5-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417584
(1R)-7,8-dimethoxy-4,5-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417582
(1R)-4,9-dimethyl-1,2,3,4-tetrahydrophenanthren-1-amine
CID 113305819
5,6,7-trimethoxy-4-methyl-N-propyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115417654
3-methoxy-5,8-dimethyl-5,6,7,8-tetrahydronaphthalen-2-ol
CID 163922079
2-(4-methoxy-2,3,5-trimethylphenyl)pyrrolidine
CID 82286064
2-(4-methoxy-2,3,5-trimethylphenyl)piperidine
CID 82290366
(4-methoxy-3,5-dimethylphenyl)-methyliodanium
CID 22251529
5-cyclopropyloxy-2-methoxy-1,3-dimethylbenzene
CID 130057399

Frequently Asked Questions

What is the IUPAC name of (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene (CID 14864209) is (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene is C=C(C)[C@H]1CC[C@H](C)c2c1cc(C)c(OC)c2OC.
What is the InChIKey of (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene?
The InChIKey is SDRDCRWQVIPPTL-WCQYABFASA-N. The full InChI is InChI=1S/C17H24O2/c1-10(2)13-8-7-11(3)15-14(13)9-12(4)16(18-5)17(15)19-6/h9,11,13H,1,7-8H2,2-6H3/t11-,13+/m0/s1.
What are the key properties of (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene?
(1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene has a molecular weight of 260.38 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,4S)-5,6-dimethoxy-4,7-dimethyl-1-prop-1-en-2-yl-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 14864209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).