5-methyl-3-piperidin-3-yl-1H-indole

C14H18N2 — CID 54857111

IUPAC5-methyl-3-piperidin-3-yl-1H-indole
SMILESCc1ccc2[nH]cc(C3CCCNC3)c2c1
InChIInChI=1S/C14H18N2/c1-10-4-5-14-12(7-10)13(9-16-14)11-3-2-6-15-8-11/h4-5,7,9,11,15-16H,2-3,6,8H2,1H3
InChIKeyLXSYOXSAELXBNT-UHFFFAOYSA-N
MW214.31 g/mol
LogP2.94
Rot. Bonds1

About 5-methyl-3-piperidin-3-yl-1H-indole

5-methyl-3-piperidin-3-yl-1H-indole (PubChem CID 54857111) has the molecular formula C14H18N2 and a molecular weight of 214.31 g/mol. Its IUPAC name is 5-methyl-3-piperidin-3-yl-1H-indole.

Molecular Properties

Compound Name5-methyl-3-piperidin-3-yl-1H-indole
PubChem CID54857111
Molecular FormulaC14H18N2
Molecular Weight214.31 g/mol
Exact Mass214.15
IUPAC Name5-methyl-3-piperidin-3-yl-1H-indole
SMILESCc1ccc2[nH]cc(C3CCCNC3)c2c1
InChIInChI=1S/C14H18N2/c1-10-4-5-14-12(7-10)13(9-16-14)11-3-2-6-15-8-11/h4-5,7,9,11,15-16H,2-3,6,8H2,1H3
InChIKeyLXSYOXSAELXBNT-UHFFFAOYSA-N
XLogP2.94
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

6-methyl-3-pyrrolidin-3-yl-1H-indole
CID 54857127
3-(2,4-dimethylphenyl)piperidine
CID 10535662
(3S)-3-(2,5-dimethylphenyl)piperidine
CID 92981749
6-fluoro-3-piperidin-3-yl-1H-indole
CID 54857103
5-bromo-3-[(3R)-pyrrolidin-3-yl]-1H-indole
CID 95432462
3-(4-methyl-2-methylsulfonylphenyl)piperidine
CID 117386774
5-methyl-3-(pyrrolidin-3-ylmethyl)-1H-indole
CID 18965344
3,5-dimethyl-8-piperidin-3-ylquinoline
CID 10243377
4,6-dichloro-3-piperidin-3-yl-1H-indole
CID 82212349
5-ethyl-4-(5-methyl-1H-indol-3-yl)-N-[(3S)-piperidin-3-yl]pyrimidin-2-amine
CID 162663968
5-methyl-3-(piperidin-4-ylmethyl)-1H-indole
CID 82494836
ethane;3-(2-methylphenyl)piperidine
CID 144655647

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-piperidin-3-yl-1H-indole?
The IUPAC name of 5-methyl-3-piperidin-3-yl-1H-indole (CID 54857111) is 5-methyl-3-piperidin-3-yl-1H-indole.
What is the SMILES notation for 5-methyl-3-piperidin-3-yl-1H-indole?
The canonical SMILES for 5-methyl-3-piperidin-3-yl-1H-indole is Cc1ccc2[nH]cc(C3CCCNC3)c2c1.
What is the InChIKey of 5-methyl-3-piperidin-3-yl-1H-indole?
The InChIKey is LXSYOXSAELXBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2/c1-10-4-5-14-12(7-10)13(9-16-14)11-3-2-6-15-8-11/h4-5,7,9,11,15-16H,2-3,6,8H2,1H3.
What are the key properties of 5-methyl-3-piperidin-3-yl-1H-indole?
5-methyl-3-piperidin-3-yl-1H-indole has a molecular weight of 214.31 g/mol, XLogP of 2.94, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-piperidin-3-yl-1H-indole is sourced from PubChem (CID 54857111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).