3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol

C11H15NO — CID 84717952

IUPAC3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol
SMILESCC1(CN)CCc2ccc(O)cc21
InChIInChI=1S/C11H15NO/c1-11(7-12)5-4-8-2-3-9(13)6-10(8)11/h2-3,6,13H,4-5,7,12H2,1H3
InChIKeySLHSXGNEJPQLFG-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.55
Rot. Bonds1

About 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol

3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol (PubChem CID 84717952) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol.

Molecular Properties

Compound Name3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol
PubChem CID84717952
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol
SMILESCC1(CN)CCc2ccc(O)cc21
InChIInChI=1S/C11H15NO/c1-11(7-12)5-4-8-2-3-9(13)6-10(8)11/h2-3,6,13H,4-5,7,12H2,1H3
InChIKeySLHSXGNEJPQLFG-UHFFFAOYSA-N
XLogP1.55
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(6-fluoro-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84718266
(6-bromo-1-methyl-2,3-dihydroinden-1-yl)methanamine
CID 84728033
8-(aminomethyl)-8-methoxy-6,7-dihydro-5H-naphthalen-2-ol
CID 105460560
2-(7-hydroxy-1-methyl-3,4-dihydro-2H-naphthalen-1-yl)acetic acid
CID 68638275
3,3-diamino-1,2-dihydroinden-5-ol
CID 66833532
(2'R,3R)-2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
CID 89082538
1-[(4-hydroxyphenyl)methyl]-1-methyl-2,3-dihydroinden-5-ol
CID 162670528
methanol;2'-methylspiro[1,2-dihydroindene-3,1'-cyclopropane]-5-ol
CID 143977527
[(1R)-1-methyl-3,4-dihydro-2H-naphthalen-1-yl]methanamine
CID 94565802
1-(2-hydroxy-2-methylpropyl)-1-methyl-2,3-dihydroinden-5-ol
CID 66557208
2-(aminomethyl)-3,4-dihydro-1H-naphthalene-2,7-diol
CID 105447110
1,1-dimethyl-3,4-dihydro-2H-isoquinolin-7-ol
CID 84717936

Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol?
The IUPAC name of 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol (CID 84717952) is 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol.
What is the SMILES notation for 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol?
The canonical SMILES for 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol is CC1(CN)CCc2ccc(O)cc21.
What is the InChIKey of 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol?
The InChIKey is SLHSXGNEJPQLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-11(7-12)5-4-8-2-3-9(13)6-10(8)11/h2-3,6,13H,4-5,7,12H2,1H3.
What are the key properties of 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol?
3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol has a molecular weight of 177.25 g/mol, XLogP of 1.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-3-methyl-1,2-dihydroinden-5-ol is sourced from PubChem (CID 84717952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).