(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene

C13H18O — CID 167327532

IUPAC(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
SMILESCc1ccc2c(c1)[C@@H](C(C)C)CCO2
InChIInChI=1S/C13H18O/c1-9(2)11-6-7-14-13-5-4-10(3)8-12(11)13/h4-5,8-9,11H,6-7H2,1-3H3/t11-/m1/s1
InChIKeyOGYKYJPFSBSEAI-LLVKDONJSA-N
MW190.29 g/mol
LogP3.52
Rot. Bonds1

About (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene

(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene (PubChem CID 167327532) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene.

Molecular Properties

Compound Name(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
PubChem CID167327532
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene
SMILESCc1ccc2c(c1)[C@@H](C(C)C)CCO2
InChIInChI=1S/C13H18O/c1-9(2)11-6-7-14-13-5-4-10(3)8-12(11)13/h4-5,8-9,11H,6-7H2,1-3H3/t11-/m1/s1
InChIKeyOGYKYJPFSBSEAI-LLVKDONJSA-N
XLogP3.52
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-methoxy-4-propan-2-yl-3,4-dihydro-2H-chromene
CID 155736305
9-methyl-2,3,3a,4,5,10b-hexahydro-1H-[1]benzoxepino[4,5-c]pyrrole
CID 67166489
1-(6-chloro-3,4-dihydro-2H-chromen-4-yl)ethanamine
CID 83909719
N-methyl-1-(6-methyl-3,4-dihydro-2H-chromen-4-yl)methanamine
CID 83907392
N-methoxy-6-methyl-3,4-dihydro-2H-chromen-4-amine
CID 81482054
2-chloro-N-(6-methyl-3,4-dihydro-2H-chromen-4-yl)propanamide
CID 108734122
6-methyl-3-propan-2-yl-2,3-dihydro-1-benzofuran
CID 163396140
(1S,4S)-1,6-dimethyl-4-propan-2-yl-1,2,3,4-tetrahydronaphthalene
CID 6429077
[(4R)-6-methyl-3,4-dihydro-2H-chromen-4-yl] acetate
CID 102427933
4-propan-2-yl-3,4-dihydro-2H-pyrano[2,3-c]pyridine
CID 59291776
6-benzyl-4-propan-2-yl-3,4-dihydro-2H-chromene;6-benzyl-4-propan-2-yl-3,4-dihydro-2H-thiochromene;ethane
CID 142306887
(1R)-4,4,7-trimethyl-1-propan-2-yl-2,3-dihydro-1H-naphthalene
CID 98564559

Frequently Asked Questions

What is the IUPAC name of (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene?
The IUPAC name of (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene (CID 167327532) is (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene.
What is the SMILES notation for (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene?
The canonical SMILES for (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene is Cc1ccc2c(c1)[C@@H](C(C)C)CCO2.
What is the InChIKey of (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene?
The InChIKey is OGYKYJPFSBSEAI-LLVKDONJSA-N. The full InChI is InChI=1S/C13H18O/c1-9(2)11-6-7-14-13-5-4-10(3)8-12(11)13/h4-5,8-9,11H,6-7H2,1-3H3/t11-/m1/s1.
What are the key properties of (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene?
(4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene has a molecular weight of 190.29 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-6-methyl-4-propan-2-yl-3,4-dihydro-2H-chromene is sourced from PubChem (CID 167327532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).