[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine

C15H15N3 — CID 83919208

IUPAC[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine
SMILESCc1[nH]c2ccccc2c1-c1ccncc1CN
InChIInChI=1S/C15H15N3/c1-10-15(12-6-7-17-9-11(12)8-16)13-4-2-3-5-14(13)18-10/h2-7,9,18H,8,16H2,1H3
InChIKeyNDWLNAUWKQQCKG-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.00
Rot. Bonds2

About [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine

[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine (PubChem CID 83919208) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine
PubChem CID83919208
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine
SMILESCc1[nH]c2ccccc2c1-c1ccncc1CN
InChIInChI=1S/C15H15N3/c1-10-15(12-6-7-17-9-11(12)8-16)13-4-2-3-5-14(13)18-10/h2-7,9,18H,8,16H2,1H3
InChIKeyNDWLNAUWKQQCKG-UHFFFAOYSA-N
XLogP3.00
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine?
The IUPAC name of [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine (CID 83919208) is [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine.
What is the SMILES notation for [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine?
The canonical SMILES for [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine is Cc1[nH]c2ccccc2c1-c1ccncc1CN.
What is the InChIKey of [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine?
The InChIKey is NDWLNAUWKQQCKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-10-15(12-6-7-17-9-11(12)8-16)13-4-2-3-5-14(13)18-10/h2-7,9,18H,8,16H2,1H3.
What are the key properties of [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine?
[4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine has a molecular weight of 237.31 g/mol, XLogP of 3.00, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methyl-1H-indol-3-yl)-3-pyridinyl]methanamine is sourced from PubChem (CID 83919208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).