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

C14H20N2 — CID 3724874

IUPAC2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(N2CCCC2)c2ccccc2N1
InChIInChI=1S/C14H20N2/c1-11-10-14(16-8-4-5-9-16)12-6-2-3-7-13(12)15-11/h2-3,6-7,11,14-15H,4-5,8-10H2,1H3
InChIKeyRFZKMPGJCSUMSO-UHFFFAOYSA-N
MW216.33 g/mol
LogP3.03
Rot. Bonds1

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

2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline (PubChem CID 3724874) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
PubChem CID3724874
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
SMILESCC1CC(N2CCCC2)c2ccccc2N1
InChIInChI=1S/C14H20N2/c1-11-10-14(16-8-4-5-9-16)12-6-2-3-7-13(12)15-11/h2-3,6-7,11,14-15H,4-5,8-10H2,1H3
InChIKeyRFZKMPGJCSUMSO-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275850
(2S,4S)-2-phenyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 10333801
6-ethyl-2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82275946
2,6,7-trimethyl-4-piperidin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82276001
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
2,6,7-trimethyl-4-piperazin-1-yl-1,2,3,4-tetrahydroquinoline
CID 82276002
(2S,4R)-4-ethoxy-2-methyl-1,2,3,4-tetrahydroquinoline
CID 131014008

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline (CID 3724874) is 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline is CC1CC(N2CCCC2)c2ccccc2N1.
What is the InChIKey of 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline?
The InChIKey is RFZKMPGJCSUMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-11-10-14(16-8-4-5-9-16)12-6-2-3-7-13(12)15-11/h2-3,6-7,11,14-15H,4-5,8-10H2,1H3.
What are the key properties of 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline?
2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline has a molecular weight of 216.33 g/mol, XLogP of 3.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-pyrrolidin-1-yl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 3724874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).