4-(piperidin-1-ylmethyl)-2-propoxypyridine

C14H22N2O — CID 54041616

IUPAC4-(piperidin-1-ylmethyl)-2-propoxypyridine
SMILESCCCOc1cc(CN2CCCCC2)ccn1
InChIInChI=1S/C14H22N2O/c1-2-10-17-14-11-13(6-7-15-14)12-16-8-4-3-5-9-16/h6-7,11H,2-5,8-10,12H2,1H3
InChIKeyMYWYDAXNNYWCBL-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.86
Rot. Bonds5

About 4-(piperidin-1-ylmethyl)-2-propoxypyridine

4-(piperidin-1-ylmethyl)-2-propoxypyridine (PubChem CID 54041616) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 4-(piperidin-1-ylmethyl)-2-propoxypyridine.

Molecular Properties

Compound Name4-(piperidin-1-ylmethyl)-2-propoxypyridine
PubChem CID54041616
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name4-(piperidin-1-ylmethyl)-2-propoxypyridine
SMILESCCCOc1cc(CN2CCCCC2)ccn1
InChIInChI=1S/C14H22N2O/c1-2-10-17-14-11-13(6-7-15-14)12-16-8-4-3-5-9-16/h6-7,11H,2-5,8-10,12H2,1H3
InChIKeyMYWYDAXNNYWCBL-UHFFFAOYSA-N
XLogP2.86
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-(piperidin-1-ylmethyl)-2-propoxypyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]butan-1-ol
CID 15228214
1-[3-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]propyl]-3-propan-2-ylurea
CID 19962926
(Z)-4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-en-1-amine;hydrochloride
CID 121230636
N'-[3-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]propyl]propanediamide
CID 139915610
(2-propoxy-4-pyridinyl)methanol
CID 61256143
3-N-[3-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]propyl]-1,2,5-thiadiazole-3,4-diamine
CID 13313699
3-[[(Z)-4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]amino]cyclobut-3-ene-1,2-dione
CID 139775806
3-oxo-3-[[(Z)-4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]amino]propanoic acid
CID 139915599
N-[(Z)-4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]-N'-propan-2-ylpropanediamide
CID 139915609
N'-[4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]propanediamide
CID 67845640
2-[(Z)-4-(oxan-2-yloxy)but-2-enoxy]-4-(piperidin-1-ylmethyl)pyridine
CID 15228209
2-[(2-methoxy-4-pyridinyl)methyl]-3,4,5,7,8,9,10,10a-octahydro-1H-pyrido[1,2-a][1,4]diazepine
CID 79926333

Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-1-ylmethyl)-2-propoxypyridine?
The IUPAC name of 4-(piperidin-1-ylmethyl)-2-propoxypyridine (CID 54041616) is 4-(piperidin-1-ylmethyl)-2-propoxypyridine.
What is the SMILES notation for 4-(piperidin-1-ylmethyl)-2-propoxypyridine?
The canonical SMILES for 4-(piperidin-1-ylmethyl)-2-propoxypyridine is CCCOc1cc(CN2CCCCC2)ccn1.
What is the InChIKey of 4-(piperidin-1-ylmethyl)-2-propoxypyridine?
The InChIKey is MYWYDAXNNYWCBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-2-10-17-14-11-13(6-7-15-14)12-16-8-4-3-5-9-16/h6-7,11H,2-5,8-10,12H2,1H3.
What are the key properties of 4-(piperidin-1-ylmethyl)-2-propoxypyridine?
4-(piperidin-1-ylmethyl)-2-propoxypyridine has a molecular weight of 234.34 g/mol, XLogP of 2.86, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-1-ylmethyl)-2-propoxypyridine is sourced from PubChem (CID 54041616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).