3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline

C16H24N2 — CID 63524793

IUPAC3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
SMILESCC1Cc2ccccc2N(CC2CCCNC2)C1
InChIInChI=1S/C16H24N2/c1-13-9-15-6-2-3-7-16(15)18(11-13)12-14-5-4-8-17-10-14/h2-3,6-7,13-14,17H,4-5,8-12H2,1H3
InChIKeyAUPWPPCWPAMSJX-UHFFFAOYSA-N
MW244.38 g/mol
LogP2.68
Rot. Bonds2

About 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline

3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline (PubChem CID 63524793) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline.

Molecular Properties

Compound Name3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
PubChem CID63524793
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC Name3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
SMILESCC1Cc2ccccc2N(CC2CCCNC2)C1
InChIInChI=1S/C16H24N2/c1-13-9-15-6-2-3-7-16(15)18(11-13)12-14-5-4-8-17-10-14/h2-3,6-7,13-14,17H,4-5,8-12H2,1H3
InChIKeyAUPWPPCWPAMSJX-UHFFFAOYSA-N
XLogP2.68
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methyl-1-piperidin-3-yl-3,4-dihydro-2H-quinoline
CID 63524612
2-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-amine
CID 63494357
2-(piperidin-3-ylmethyl)-1,3-dihydroisoindole
CID 62205557
1-cyclopropyl-4-(piperidin-3-ylmethyl)-2,3-dihydroquinoxaline
CID 120849285
3-[[(3R)-piperidin-3-yl]methyl]-1,4-dihydroquinazolin-2-one
CID 97169092
1-[2-[(3S)-piperidin-3-yl]ethyl]-3,4-dihydro-2H-quinoline
CID 86323488
1-(2-piperidin-3-ylethyl)-2,3-dihydroindole;dihydrochloride
CID 53408240
1-[(4-methoxypyrrolidin-2-yl)methyl]-3-methyl-3,4-dihydro-2H-quinoline
CID 63534433
2,2-dimethyl-6-[(3-methyl-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclohexan-1-ol
CID 79843525
2-(3-methyl-3,4-dihydro-2H-quinolin-1-yl)acetonitrile
CID 15304197
2-methyl-1-(pyrrolidin-3-ylmethyl)-3,4-dihydro-2H-quinoline
CID 62372829
1-(2,3-dimethylphenyl)-4-(piperidin-3-ylmethyl)piperazine
CID 43245867

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline?
The IUPAC name of 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline (CID 63524793) is 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline.
What is the SMILES notation for 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline?
The canonical SMILES for 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline is CC1Cc2ccccc2N(CC2CCCNC2)C1.
What is the InChIKey of 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline?
The InChIKey is AUPWPPCWPAMSJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-13-9-15-6-2-3-7-16(15)18(11-13)12-14-5-4-8-17-10-14/h2-3,6-7,13-14,17H,4-5,8-12H2,1H3.
What are the key properties of 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline?
3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline has a molecular weight of 244.38 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(piperidin-3-ylmethyl)-3,4-dihydro-2H-quinoline is sourced from PubChem (CID 63524793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).