2-methyl-3-pyridin-4-yl-1H-indole

C14H12N2 — CID 11962095

IUPAC2-methyl-3-pyridin-4-yl-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1ccncc1
InChIInChI=1S/C14H12N2/c1-10-14(11-6-8-15-9-7-11)12-4-2-3-5-13(12)16-10/h2-9,16H,1H3
InChIKeyNMPHKIHQOKMIKF-UHFFFAOYSA-N
MW208.26 g/mol
LogP3.54
Rot. Bonds1

About 2-methyl-3-pyridin-4-yl-1H-indole

2-methyl-3-pyridin-4-yl-1H-indole (PubChem CID 11962095) has the molecular formula C14H12N2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-methyl-3-pyridin-4-yl-1H-indole.

Molecular Properties

Compound Name2-methyl-3-pyridin-4-yl-1H-indole
PubChem CID11962095
Molecular FormulaC14H12N2
Molecular Weight208.26 g/mol
Exact Mass208.10
IUPAC Name2-methyl-3-pyridin-4-yl-1H-indole
SMILESCc1[nH]c2ccccc2c1-c1ccncc1
InChIInChI=1S/C14H12N2/c1-10-14(11-6-8-15-9-7-11)12-4-2-3-5-13(12)16-10/h2-9,16H,1H3
InChIKeyNMPHKIHQOKMIKF-UHFFFAOYSA-N
XLogP3.54
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Indole
CID 798
Skatole
CID 6736
Tryptamine
CID 1150
N,N-Dimethyltryptamine
CID 6089
Carbazole
CID 6854
3,3'-Diindolylmethane
CID 3071
Gramine
CID 6890
Beta-Carboline
CID 64961
(+-)-alpha-Methyltryptamine
CID 9287
Naratriptan
CID 4440
Methyltryptamine
CID 6088
Tetrahydro-beta-carboline
CID 107838

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-pyridin-4-yl-1H-indole?
The IUPAC name of 2-methyl-3-pyridin-4-yl-1H-indole (CID 11962095) is 2-methyl-3-pyridin-4-yl-1H-indole.
What is the SMILES notation for 2-methyl-3-pyridin-4-yl-1H-indole?
The canonical SMILES for 2-methyl-3-pyridin-4-yl-1H-indole is Cc1[nH]c2ccccc2c1-c1ccncc1.
What is the InChIKey of 2-methyl-3-pyridin-4-yl-1H-indole?
The InChIKey is NMPHKIHQOKMIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2/c1-10-14(11-6-8-15-9-7-11)12-4-2-3-5-13(12)16-10/h2-9,16H,1H3.
What are the key properties of 2-methyl-3-pyridin-4-yl-1H-indole?
2-methyl-3-pyridin-4-yl-1H-indole has a molecular weight of 208.26 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-pyridin-4-yl-1H-indole is sourced from PubChem (CID 11962095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).