[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine

C11H15N — CID 58681536

IUPAC[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine
SMILESC[C@H]1C[C@@H](CN)c2ccccc21
InChIInChI=1S/C11H15N/c1-8-6-9(7-12)11-5-3-2-4-10(8)11/h2-5,8-9H,6-7,12H2,1H3/t8-,9-/m0/s1
InChIKeyQOSMGAXJMMHOLQ-IUCAKERBSA-N
MW161.25 g/mol
LogP2.24
Rot. Bonds1

About [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine

[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine (PubChem CID 58681536) has the molecular formula C11H15N and a molecular weight of 161.25 g/mol. Its IUPAC name is [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine.

Molecular Properties

Compound Name[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine
PubChem CID58681536
Molecular FormulaC11H15N
Molecular Weight161.25 g/mol
Exact Mass161.12
IUPAC Name[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine
SMILESC[C@H]1C[C@@H](CN)c2ccccc21
InChIInChI=1S/C11H15N/c1-8-6-9(7-12)11-5-3-2-4-10(8)11/h2-5,8-9H,6-7,12H2,1H3/t8-,9-/m0/s1
InChIKeyQOSMGAXJMMHOLQ-IUCAKERBSA-N
XLogP2.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1S,3S)-3-methyl-2,3-dihydro-1H-inden-1-amine
CID 28502914
(3S)-1,3-dimethyl-2,3-dihydro-1H-indene
CID 143951833
(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-ol
CID 640582
(1-amino-4-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)methanol
CID 115420649
(5-bromo-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84635120
(3R)-1-ethyl-3-methyl-5-phenyl-2,3-dihydro-1H-indene;methanamine
CID 144777782
(1R)-1-methyl-3-phenyl-2,3-dihydro-1H-indene
CID 163676750
2-ethylsulfonyl-4-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 113306113
(5-methoxy-3-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)methanamine
CID 84620615
3-ethyl-5-fluoro-1-methyl-2,3-dihydro-1H-indene
CID 126625151
2-(3-methyl-2,3-dihydro-1H-inden-1-yl)phenol
CID 174602517
3-methyl-2,3-dihydro-1H-indene-1-carbonitrile
CID 21040228

Frequently Asked Questions

What is the IUPAC name of [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine?
The IUPAC name of [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine (CID 58681536) is [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine.
What is the SMILES notation for [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine?
The canonical SMILES for [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine is C[C@H]1C[C@@H](CN)c2ccccc21.
What is the InChIKey of [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine?
The InChIKey is QOSMGAXJMMHOLQ-IUCAKERBSA-N. The full InChI is InChI=1S/C11H15N/c1-8-6-9(7-12)11-5-3-2-4-10(8)11/h2-5,8-9H,6-7,12H2,1H3/t8-,9-/m0/s1.
What are the key properties of [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine?
[(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine has a molecular weight of 161.25 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,3S)-3-methyl-2,3-dihydro-1H-inden-1-yl]methanamine is sourced from PubChem (CID 58681536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).