2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline

C15H22N2 — CID 82275850

IUPAC2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(N2CCCCC2)c2ccccc2N1
InChIInChI=1S/C15H22N2/c1-12-11-15(17-9-5-2-6-10-17)13-7-3-4-8-14(13)16-12/h3-4,7-8,12,15-16H,2,5-6,9-11H2,1H3
InChIKeyBSKGIJUJWATMFU-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.42
Rot. Bonds1

About 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline

2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline (PubChem CID 82275850) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
PubChem CID82275850
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(N2CCCCC2)c2ccccc2N1
InChIInChI=1S/C15H22N2/c1-12-11-15(17-9-5-2-6-10-17)13-7-3-4-8-14(13)16-12/h3-4,7-8,12,15-16H,2,5-6,9-11H2,1H3
InChIKeyBSKGIJUJWATMFU-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 3724874
(2S,4S)-2-phenyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 10333801
2,6,7-trimethyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82276001
6-ethyl-2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275946
4-methoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 82275853
2,5,7-trimethyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275992
4-(6-chloro-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)morpholine
CID 82275927
4-butan-2-yl-2-methyl-1,2,3,4-tetrahydroquinoline
CID 106780808
(2R,4R)-2-methyl-1,2,3,4-tetrahydroquinoline-4-carboxylic acid
CID 95566944
[(2S,6R)-2,6-dimethylpiperidin-1-yl]-(2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)methanone
CID 104967543
(2S,4R)-4-ethoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 131014008
(2R,4S)-2-methyl-N-phenyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 715781

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline (CID 82275850) is 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline is CC1CC(N2CCCCC2)c2ccccc2N1.
What is the InChIKey of 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline?
The InChIKey is BSKGIJUJWATMFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c1-12-11-15(17-9-5-2-6-10-17)13-7-3-4-8-14(13)16-12/h3-4,7-8,12,15-16H,2,5-6,9-11H2,1H3.
What are the key properties of 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline?
2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline has a molecular weight of 230.35 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 82275850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).