4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol

C17H25NO — CID 62610401

IUPAC4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CN2c3ccccc3CC2C)C1
InChIInChI=1S/C17H25NO/c1-12-7-8-17(19)15(9-12)11-18-13(2)10-14-5-3-4-6-16(14)18/h3-6,12-13,15,17,19H,7-11H2,1-2H3
InChIKeyVAYUWRUDOCTJKZ-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.23
Rot. Bonds2

About 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol

4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol (PubChem CID 62610401) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol
PubChem CID62610401
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol
SMILESCC1CCC(O)C(CN2c3ccccc3CC2C)C1
InChIInChI=1S/C17H25NO/c1-12-7-8-17(19)15(9-12)11-18-13(2)10-14-5-3-4-6-16(14)18/h3-6,12-13,15,17,19H,7-11H2,1-2H3
InChIKeyVAYUWRUDOCTJKZ-UHFFFAOYSA-N
XLogP3.23
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,4-dimethyl-2-[(2-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
CID 63481960
N-methyl-3-[(2-methyl-2,3-dihydroindol-1-yl)methyl]oxan-4-amine
CID 103058526
2-methyl-1-(2-methyl-2,3-dihydroindol-1-yl)propan-2-ol
CID 54242402
1-(2-methyl-2,3-dihydroindol-1-yl)pentan-2-ol
CID 62044766
2-methyl-1-(piperidin-2-ylmethyl)-2,3-dihydroindole
CID 24692606
2-[2-(2-methyl-2,3-dihydroindol-1-yl)ethyl]cyclopentan-1-amine
CID 79570177
2-(2-methyl-2,3-dihydroindol-1-yl)acetamide
CID 22200023
2-methyl-3-(2-methyl-2,3-dihydroindol-1-yl)propan-1-amine
CID 43367603
N-(cyclopropylmethyl)-2-(2-methyl-2,3-dihydroindol-1-yl)ethanamine
CID 60866414
2-methyl-1-[(4-methylpyrrolidin-3-yl)methyl]-3,4-dihydro-2H-quinoline
CID 63716022
1,2-bis(2-methyl-2,3-dihydroindol-1-yl)ethanone
CID 73142226
4-[(2-methyl-2,3-dihydroindol-1-yl)methyl]-1,2,3,4-tetrahydroisoquinoline
CID 65262029

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol (CID 62610401) is 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol is CC1CCC(O)C(CN2c3ccccc3CC2C)C1.
What is the InChIKey of 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol?
The InChIKey is VAYUWRUDOCTJKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-12-7-8-17(19)15(9-12)11-18-13(2)10-14-5-3-4-6-16(14)18/h3-6,12-13,15,17,19H,7-11H2,1-2H3.
What are the key properties of 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol?
4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol has a molecular weight of 259.39 g/mol, XLogP of 3.23, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[(2-methyl-2,3-dihydroindol-1-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 62610401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).