5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole

C17H19N3 — CID 116986169

IUPAC5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole
SMILESCn1c2ccncc2c2ccc(C3CCCCN3)cc21
InChIInChI=1S/C17H19N3/c1-20-16-7-9-18-11-14(16)13-6-5-12(10-17(13)20)15-4-2-3-8-19-15/h5-7,9-11,15,19H,2-4,8H2,1H3
InChIKeyIIWCQRHXKAMNLC-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.54
Rot. Bonds1

About 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole

5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole (PubChem CID 116986169) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole.

Molecular Properties

Compound Name5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole
PubChem CID116986169
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole
SMILESCn1c2ccncc2c2ccc(C3CCCCN3)cc21
InChIInChI=1S/C17H19N3/c1-20-16-7-9-18-11-14(16)13-6-5-12(10-17(13)20)15-4-2-3-8-19-15/h5-7,9-11,15,19H,2-4,8H2,1H3
InChIKeyIIWCQRHXKAMNLC-UHFFFAOYSA-N
XLogP3.54
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-6-piperidin-2-ylindazole;hydrochloride
CID 154883669
4-tert-butyl-7-piperidin-2-ylisoquinoline
CID 117424916
acetic acid;3-piperidin-2-ylpyridine
CID 175134059
5-methyl-7-phenylpyrido[4,3-b]indole
CID 155583386
(5-methylpyrido[4,3-b]indol-7-yl)methanol
CID 116986177
2-fluoro-5-[(2S)-piperidin-2-yl]pyridine
CID 55277900
6-piperidin-2-ylquinoxaline
CID 171487792
4-[(2S)-piperidin-2-yl]pyridine-3-carbonitrile
CID 55263705
3-methyl-5-[(2R)-piperidin-2-yl]pyridine
CID 96741558
2-(3-chloro-4-pyridinyl)azepane
CID 4542495
6-(azepan-2-yl)-1H-indazole
CID 81146636
4-[(2S)-piperidin-2-yl]pyridazine;hydrochloride
CID 138376376

Frequently Asked Questions

What is the IUPAC name of 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole?
The IUPAC name of 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole (CID 116986169) is 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole.
What is the SMILES notation for 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole?
The canonical SMILES for 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole is Cn1c2ccncc2c2ccc(C3CCCCN3)cc21.
What is the InChIKey of 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole?
The InChIKey is IIWCQRHXKAMNLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-20-16-7-9-18-11-14(16)13-6-5-12(10-17(13)20)15-4-2-3-8-19-15/h5-7,9-11,15,19H,2-4,8H2,1H3.
What are the key properties of 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole?
5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole has a molecular weight of 265.36 g/mol, XLogP of 3.54, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-7-piperidin-2-ylpyrido[4,3-b]indole is sourced from PubChem (CID 116986169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).