N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine

C12H15N — CID 105435597

IUPACN-methyl-1-(7-methyl-1H-inden-2-yl)methanamine
SMILESCNCC1=Cc2cccc(C)c2C1
InChIInChI=1S/C12H15N/c1-9-4-3-5-11-6-10(8-13-2)7-12(9)11/h3-6,13H,7-8H2,1-2H3
InChIKeyOOMCJVQQARSOBU-UHFFFAOYSA-N
MW173.26 g/mol
LogP2.15
Rot. Bonds2

About N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine

N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine (PubChem CID 105435597) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(7-methyl-1H-inden-2-yl)methanamine
PubChem CID105435597
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC NameN-methyl-1-(7-methyl-1H-inden-2-yl)methanamine
SMILESCNCC1=Cc2cccc(C)c2C1
InChIInChI=1S/C12H15N/c1-9-4-3-5-11-6-10(8-13-2)7-12(9)11/h3-6,13H,7-8H2,1-2H3
InChIKeyOOMCJVQQARSOBU-UHFFFAOYSA-N
XLogP2.15
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine?
The IUPAC name of N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine (CID 105435597) is N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine is CNCC1=Cc2cccc(C)c2C1.
What is the InChIKey of N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine?
The InChIKey is OOMCJVQQARSOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N/c1-9-4-3-5-11-6-10(8-13-2)7-12(9)11/h3-6,13H,7-8H2,1-2H3.
What are the key properties of N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine?
N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine has a molecular weight of 173.26 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(7-methyl-1H-inden-2-yl)methanamine is sourced from PubChem (CID 105435597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).