(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol

C17H24O2 — CID 104950429

IUPAC(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
SMILESCc1ccc2c(c1)[C@H](O)CC1(CCC(C)CC1C)O2
InChIInChI=1S/C17H24O2/c1-11-4-5-16-14(9-11)15(18)10-17(19-16)7-6-12(2)8-13(17)3/h4-5,9,12-13,15,18H,6-8,10H2,1-3H3/t12?,13?,15-,17?/m1/s1
InChIKeyNEFGLTJUSNYCHW-QNJCKLSPSA-N
MW260.38 g/mol
LogP4.01
Rot. Bonds

About (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol

(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol (PubChem CID 104950429) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol.

Molecular Properties

Compound Name(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
PubChem CID104950429
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
SMILESCc1ccc2c(c1)[C@H](O)CC1(CCC(C)CC1C)O2
InChIInChI=1S/C17H24O2/c1-11-4-5-16-14(9-11)15(18)10-17(19-16)7-6-12(2)8-13(17)3/h4-5,9,12-13,15,18H,6-8,10H2,1-3H3/t12?,13?,15-,17?/m1/s1
InChIKeyNEFGLTJUSNYCHW-QNJCKLSPSA-N
XLogP4.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol 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

(4R)-6-chloro-2',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104949249
(4R)-6-methoxy-2',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104951051
3',6-dimethylspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ol
CID 114715175
(4S)-6-bromo-2',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 104947297
4'-methoxy-6-methylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 114715070
(4R)-2',6-dimethylspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-amine
CID 104946615
(4S)-3'-methoxy-6-methylspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825056
(4S)-6-methylspiro[3,4-dihydrochromene-2,4'-thiane]-4-ol
CID 104950482
6-chloro-N-ethyl-2',4'-dimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-amine
CID 114711391
N,2',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-amine
CID 114712548
(4S)-1'-cyclopropyl-2',6-dimethylspiro[3,4-dihydrochromene-2,4'-pyrrolidine]-4-ol
CID 104950590
2,6-dimethyl-2-propyl-3,4-dihydrochromen-4-ol
CID 114715147

Frequently Asked Questions

What is the IUPAC name of (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol?
The IUPAC name of (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol (CID 104950429) is (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol.
What is the SMILES notation for (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol?
The canonical SMILES for (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol is Cc1ccc2c(c1)[C@H](O)CC1(CCC(C)CC1C)O2.
What is the InChIKey of (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol?
The InChIKey is NEFGLTJUSNYCHW-QNJCKLSPSA-N. The full InChI is InChI=1S/C17H24O2/c1-11-4-5-16-14(9-11)15(18)10-17(19-16)7-6-12(2)8-13(17)3/h4-5,9,12-13,15,18H,6-8,10H2,1-3H3/t12?,13?,15-,17?/m1/s1.
What are the key properties of (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol?
(4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol has a molecular weight of 260.38 g/mol, XLogP of 4.01, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-2',4',6-trimethylspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol is sourced from PubChem (CID 104950429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).