4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol

C10H19NO — CID 131131730

IUPAC4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol
SMILESCC1CCNC2C(O)CCCC12
InChIInChI=1S/C10H19NO/c1-7-5-6-11-10-8(7)3-2-4-9(10)12/h7-12H,2-6H2,1H3
InChIKeyHBWMRNFKCZNGFS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.15
Rot. Bonds

About 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol

4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol (PubChem CID 131131730) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol.

Molecular Properties

Compound Name4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol
PubChem CID131131730
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol
SMILESCC1CCNC2C(O)CCCC12
InChIInChI=1S/C10H19NO/c1-7-5-6-11-10-8(7)3-2-4-9(10)12/h7-12H,2-6H2,1H3
InChIKeyHBWMRNFKCZNGFS-UHFFFAOYSA-N
XLogP1.15
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

cis-(1S,2R)-2-methylcyclopentan-1-ol
CID 642631
2-[(1S,4R,5R)-4,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]piperidin-3-ol
CID 143055461
4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline
CID 524017
2-cyclobutylpiperidin-3-ol
CID 115012112
5,7-dimethyl-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridine;ethane;methane
CID 157051839
ethane;2-methylcyclohexan-1-ol;2-methylcyclopentan-1-ol
CID 157029785
7-methyl-2-azabicyclo[4.1.0]heptane
CID 117045891
(3aR,7R,7aS)-7-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
CID 124603442
(4S,4aR,7aS)-2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[b]pyridin-4-ol
CID 25067678
cis-(1S,2R)-1-methyl-2-[(1R)-2-methylcyclopentyl]cyclopentane
CID 91373089
(1R,4aR,5S,8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1,5-diol
CID 11907324
ethane;(1R)-2-methylcyclohexan-1-ol
CID 142359109

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol?
The IUPAC name of 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol (CID 131131730) is 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol.
What is the SMILES notation for 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol?
The canonical SMILES for 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol is CC1CCNC2C(O)CCCC12.
What is the InChIKey of 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol?
The InChIKey is HBWMRNFKCZNGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-7-5-6-11-10-8(7)3-2-4-9(10)12/h7-12H,2-6H2,1H3.
What are the key properties of 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol?
4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol has a molecular weight of 169.27 g/mol, XLogP of 1.15, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinolin-8-ol is sourced from PubChem (CID 131131730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).