[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine

C13H16N2 — CID 26342575

IUPAC[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
SMILESNC[C@H]1CCCc2c1[nH]c1ccccc21
InChIInChI=1S/C13H16N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-2,5,7,9,15H,3-4,6,8,14H2/t9-/m1/s1
InChIKeyJGTWNJYBSOLIHR-SECBINFHSA-N
MW200.28 g/mol
LogP2.55
Rot. Bonds1

About [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine

[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine (PubChem CID 26342575) has the molecular formula C13H16N2 and a molecular weight of 200.28 g/mol. Its IUPAC name is [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine.

Molecular Properties

Compound Name[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
PubChem CID26342575
Molecular FormulaC13H16N2
Molecular Weight200.28 g/mol
Exact Mass200.13
IUPAC Name[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine
SMILESNC[C@H]1CCCc2c1[nH]c1ccccc21
InChIInChI=1S/C13H16N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-2,5,7,9,15H,3-4,6,8,14H2/t9-/m1/s1
InChIKeyJGTWNJYBSOLIHR-SECBINFHSA-N
XLogP2.55
TPSA41.81 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine?
The IUPAC name of [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine (CID 26342575) is [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine.
What is the SMILES notation for [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine?
The canonical SMILES for [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine is NC[C@H]1CCCc2c1[nH]c1ccccc21.
What is the InChIKey of [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine?
The InChIKey is JGTWNJYBSOLIHR-SECBINFHSA-N. The full InChI is InChI=1S/C13H16N2/c14-8-9-4-3-6-11-10-5-1-2-7-12(10)15-13(9)11/h1-2,5,7,9,15H,3-4,6,8,14H2/t9-/m1/s1.
What are the key properties of [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine?
[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine has a molecular weight of 200.28 g/mol, XLogP of 2.55, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]methanamine is sourced from PubChem (CID 26342575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).