(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol

C16H24O3 — CID 104951003

IUPAC(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol
SMILESCCCC1(CCC)C[C@@H](O)c2cc(OC)ccc2O1
InChIInChI=1S/C16H24O3/c1-4-8-16(9-5-2)11-14(17)13-10-12(18-3)6-7-15(13)19-16/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3/t14-/m1/s1
InChIKeyZNJLZILDLVQCQV-CQSZACIVSA-N
MW264.37 g/mol
LogP3.85
Rot. Bonds5

About (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol

(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol (PubChem CID 104951003) has the molecular formula C16H24O3 and a molecular weight of 264.37 g/mol. Its IUPAC name is (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol.

Molecular Properties

Compound Name(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol
PubChem CID104951003
Molecular FormulaC16H24O3
Molecular Weight264.37 g/mol
Exact Mass264.17
IUPAC Name(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol
SMILESCCCC1(CCC)C[C@@H](O)c2cc(OC)ccc2O1
InChIInChI=1S/C16H24O3/c1-4-8-16(9-5-2)11-14(17)13-10-12(18-3)6-7-15(13)19-16/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3/t14-/m1/s1
InChIKeyZNJLZILDLVQCQV-CQSZACIVSA-N
XLogP3.85
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-butyl-2-ethyl-6-methoxy-3,4-dihydrochromen-4-ol
CID 114715453
6-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
CID 114712983
6-methoxy-2-(2-methoxyethyl)-2-methyl-3,4-dihydrochromen-4-ol
CID 114715309
6-methoxy-2-methyl-2-propan-2-yl-3,4-dihydrochromen-4-ol
CID 114715446
(4R)-6-methoxy-2-methyl-2-(3-methylbutyl)-3,4-dihydrochromen-4-ol
CID 104951004
(4S)-6-methoxy-1'-propylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 104950732
(4S)-3',6-dimethoxyspiro[3,4-dihydrochromene-2,1'-cyclobutane]-4-ol
CID 106825058
(4S)-6-methoxyspiro[3,4-dihydrochromene-2,1'-cyclohexane]-4-ol
CID 104950862
6-methoxy-2-methyl-2-(2-methylpropyl)-3,4-dihydrochromen-4-ol
CID 114715296
7-methoxy-N-methyl-2,2-dipropyl-3,4-dihydrochromen-4-amine
CID 114710932
2'-ethyl-6-methoxyspiro[3,4-dihydrochromene-2,1'-cyclopentane]-4-ol
CID 114715432
6-methoxy-1'-methylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-ol
CID 59620250

Frequently Asked Questions

What is the IUPAC name of (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol?
The IUPAC name of (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol (CID 104951003) is (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol.
What is the SMILES notation for (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol?
The canonical SMILES for (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol is CCCC1(CCC)C[C@@H](O)c2cc(OC)ccc2O1.
What is the InChIKey of (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol?
The InChIKey is ZNJLZILDLVQCQV-CQSZACIVSA-N. The full InChI is InChI=1S/C16H24O3/c1-4-8-16(9-5-2)11-14(17)13-10-12(18-3)6-7-15(13)19-16/h6-7,10,14,17H,4-5,8-9,11H2,1-3H3/t14-/m1/s1.
What are the key properties of (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol?
(4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol has a molecular weight of 264.37 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-methoxy-2,2-dipropyl-3,4-dihydrochromen-4-ol is sourced from PubChem (CID 104951003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).