6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole

C14H16N2O — CID 168941676

IUPAC6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole
SMILESCOc1ccc2c(C3=CCCNC3)c[nH]c2c1
InChIInChI=1S/C14H16N2O/c1-17-11-4-5-12-13(9-16-14(12)7-11)10-3-2-6-15-8-10/h3-5,7,9,15-16H,2,6,8H2,1H3
InChIKeyUNJIBFPWUDHFRO-UHFFFAOYSA-N
MW228.30 g/mol
LogP2.55
Rot. Bonds2

About 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole

6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole (PubChem CID 168941676) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole.

Molecular Properties

Compound Name6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole
PubChem CID168941676
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole
SMILESCOc1ccc2c(C3=CCCNC3)c[nH]c2c1
InChIInChI=1S/C14H16N2O/c1-17-11-4-5-12-13(9-16-14(12)7-11)10-3-2-6-15-8-10/h3-5,7,9,15-16H,2,6,8H2,1H3
InChIKeyUNJIBFPWUDHFRO-UHFFFAOYSA-N
XLogP2.55
TPSA37.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole
CID 168941463
6-methoxy-3-(1-propyl-3,6-dihydro-2H-pyridin-4-yl)-1H-indole
CID 3055742
6-methoxy-3-(piperidin-4-ylmethyl)-1H-indole
CID 82497673
3-[(2S)-aziridin-2-yl]-6-methoxy-1H-indole
CID 55263522
7-methoxy-3-phenyl-1H-quinolin-4-one
CID 18771325
6-methoxy-1H-indole-3-carbonitrile
CID 53401197
3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole-7-carbonitrile
CID 176569727
4-(6-methoxy-1H-indol-3-yl)butane-2,2-diamine
CID 19837016
2-(6-methoxy-1H-indol-3-yl)-6,7,8,9-tetrahydroimidazo[1,2-b][1,2,4]benzotriazine
CID 46981354
6-methoxy-3-[(1-methylpiperazin-2-yl)methyl]-1H-indole
CID 84637869
4-methyl-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-pyrrolo[2,3-b]pyridine
CID 168941722
N-(1,1-dioxothiolan-3-yl)-2-(6-methoxy-1H-indol-3-yl)acetamide
CID 110852767

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole?
The IUPAC name of 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole (CID 168941676) is 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole.
What is the SMILES notation for 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole?
The canonical SMILES for 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole is COc1ccc2c(C3=CCCNC3)c[nH]c2c1.
What is the InChIKey of 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole?
The InChIKey is UNJIBFPWUDHFRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-17-11-4-5-12-13(9-16-14(12)7-11)10-3-2-6-15-8-10/h3-5,7,9,15-16H,2,6,8H2,1H3.
What are the key properties of 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole?
6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole has a molecular weight of 228.30 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indole is sourced from PubChem (CID 168941676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).