N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine

C11H14N2 — CID 161203185

IUPACN-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine
SMILESC=C1Cc2cc(CNC)ccc2N1
InChIInChI=1S/C11H14N2/c1-8-5-10-6-9(7-12-2)3-4-11(10)13-8/h3-4,6,12-13H,1,5,7H2,2H3
InChIKeyQHUBEDWUVZAKJF-UHFFFAOYSA-N
MW174.25 g/mol
LogP1.89
Rot. Bonds2

About N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine

N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine (PubChem CID 161203185) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine
PubChem CID161203185
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC NameN-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine
SMILESC=C1Cc2cc(CNC)ccc2N1
InChIInChI=1S/C11H14N2/c1-8-5-10-6-9(7-12-2)3-4-11(10)13-8/h3-4,6,12-13H,1,5,7H2,2H3
InChIKeyQHUBEDWUVZAKJF-UHFFFAOYSA-N
XLogP1.89
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine?
The IUPAC name of N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine (CID 161203185) is N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine.
What is the SMILES notation for N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine?
The canonical SMILES for N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine is C=C1Cc2cc(CNC)ccc2N1.
What is the InChIKey of N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine?
The InChIKey is QHUBEDWUVZAKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-8-5-10-6-9(7-12-2)3-4-11(10)13-8/h3-4,6,12-13H,1,5,7H2,2H3.
What are the key properties of N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine?
N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine has a molecular weight of 174.25 g/mol, XLogP of 1.89, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylidene-1,3-dihydroindol-5-yl)methanamine is sourced from PubChem (CID 161203185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).