4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine

C13H24N2O — CID 114410697

IUPAC4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(CCOC2CCNCC2)CC1
InChIInChI=1S/C13H24N2O/c1-12-4-8-15(9-5-12)10-11-16-13-2-6-14-7-3-13/h4,13-14H,2-3,5-11H2,1H3
InChIKeyPHBWKOUAWQQQKR-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.41
Rot. Bonds4

About 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine

4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine (PubChem CID 114410697) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
PubChem CID114410697
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine
SMILESCC1=CCN(CCOC2CCNCC2)CC1
InChIInChI=1S/C13H24N2O/c1-12-4-8-15(9-5-12)10-11-16-13-2-6-14-7-3-13/h4,13-14H,2-3,5-11H2,1H3
InChIKeyPHBWKOUAWQQQKR-UHFFFAOYSA-N
XLogP1.41
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(1-Methyl-1,2,5,6-tetrahydropyridin-3-yl)morpholine
CID 16736003
2-[2-[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]ethyl]morpholine
CID 113591697
2-[[4-(trifluoromethyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]morpholine
CID 114489989
1-(2-piperidin-4-yloxyethyl)-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine
CID 114490187
1-(3-piperidin-4-yloxypropyl)-4-(trifluoromethyl)-3,6-dihydro-2H-pyridine
CID 114490197
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]cyclohex-2-en-1-amine
CID 70892510
3-(2,6-dimethylmorpholin-4-yl)-N-methylcyclohex-2-en-1-amine
CID 70974379
(1R)-4-(2,6-dimethylmorpholin-4-yl)cyclohex-2-en-1-amine
CID 70974391
4-(2,6-Dimethylmorpholin-4-yl)cyclohex-2-en-1-amine
CID 71080599
4-[2-(1,2,3,6-Tetrahydropyridin-4-yl)ethyl]morpholine
CID 107489754
4-(2-Piperidin-4-ylideneethyl)morpholine
CID 115020790
N-(2-methoxyethyl)-N,5-dimethyl-6-piperidin-4-ylidene-2-prop-1-en-2-ylhexa-2,4-dien-1-amine
CID 123796658

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The IUPAC name of 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine (CID 114410697) is 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine is CC1=CCN(CCOC2CCNCC2)CC1.
What is the InChIKey of 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
The InChIKey is PHBWKOUAWQQQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-12-4-8-15(9-5-12)10-11-16-13-2-6-14-7-3-13/h4,13-14H,2-3,5-11H2,1H3.
What are the key properties of 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine?
4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine has a molecular weight of 224.35 g/mol, XLogP of 1.41, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-piperidin-4-yloxyethyl)-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 114410697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).