6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide

C25H30N4O2 — CID 25121833

IUPAC6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
SMILESCC1CCCCN1CCNCc1ccc(Oc2ccc(C(N)=O)cn2)c2ccccc12
InChIInChI=1S/C25H30N4O2/c1-18-6-4-5-14-29(18)15-13-27-16-19-9-11-23(22-8-3-2-7-21(19)22)31-24-12-10-20(17-28-24)25(26)30/h2-3,7-12,17-18,27H,4-6,13-16H2,1H3,(H2,26,30)
InChIKeyFXJFUNXZAYYMRA-UHFFFAOYSA-N
MW418.54 g/mol
LogP4.09
Rot. Bonds8

About 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide

6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide (PubChem CID 25121833) has the molecular formula C25H30N4O2 and a molecular weight of 418.54 g/mol. Its IUPAC name is 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide.

Molecular Properties

Compound Name6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
PubChem CID25121833
Molecular FormulaC25H30N4O2
Molecular Weight418.54 g/mol
Exact Mass418.24
IUPAC Name6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
SMILESCC1CCCCN1CCNCc1ccc(Oc2ccc(C(N)=O)cn2)c2ccccc12
InChIInChI=1S/C25H30N4O2/c1-18-6-4-5-14-29(18)15-13-27-16-19-9-11-23(22-8-3-2-7-21(19)22)31-24-12-10-20(17-28-24)25(26)30/h2-3,7-12,17-18,27H,4-6,13-16H2,1H3,(H2,26,30)
InChIKeyFXJFUNXZAYYMRA-UHFFFAOYSA-N
XLogP4.09
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.54
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide 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

6-[5-[(cyclohexylmethylamino)methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
CID 25119727
6-[4-[(1-oxaspiro[4.4]nonan-3-ylamino)methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
CID 59401296
6-[5-[[(4-tert-butylcyclohexyl)amino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
CID 59401364
6-[4-[(3-fluoroazetidin-1-yl)methyl]naphthalen-1-yl]oxypyridine-3-carboxamide;6-[4-[[4-(trifluoromethyl)piperidin-1-yl]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide
CID 158474137
1-[[6-(2-ethoxyphenoxy)-3-pyridinyl]methyl]-3-[3-(2-methylpiperidin-1-yl)propyl]urea
CID 47066580
4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]benzoic acid
CID 122030315
2-(2-methylpiperidin-1-yl)-N-[[2-(pyridin-3-ylmethoxy)phenyl]methyl]ethanamine
CID 119111242
4-[2-[(2R)-2-methylpiperidin-1-yl]ethylsulfamoyl]benzamide
CID 94182162
6-hydrazinyl-N-[3-(2-methylpiperidin-1-yl)propyl]pyridine-3-carboxamide
CID 62237824
3-fluoro-4-[6-methoxy-7-[3-(2-methylpiperidin-1-yl)propoxy]quinolin-4-yl]oxybenzamide
CID 67959112
1-[[6-(cyclopropylmethoxy)-3-pyridinyl]methyl]-3-[3-[(2R)-2-methylpiperidin-1-yl]propyl]urea
CID 95687305
2-[2-(2-methylpiperidin-1-yl)ethoxy]benzoic acid
CID 23009931

Frequently Asked Questions

What is the IUPAC name of 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide?
The IUPAC name of 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide (CID 25121833) is 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide.
What is the SMILES notation for 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide?
The canonical SMILES for 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide is CC1CCCCN1CCNCc1ccc(Oc2ccc(C(N)=O)cn2)c2ccccc12.
What is the InChIKey of 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide?
The InChIKey is FXJFUNXZAYYMRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30N4O2/c1-18-6-4-5-14-29(18)15-13-27-16-19-9-11-23(22-8-3-2-7-21(19)22)31-24-12-10-20(17-28-24)25(26)30/h2-3,7-12,17-18,27H,4-6,13-16H2,1H3,(H2,26,30).
What are the key properties of 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide?
6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide has a molecular weight of 418.54 g/mol, XLogP of 4.09, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[[2-(2-methylpiperidin-1-yl)ethylamino]methyl]naphthalen-1-yl]oxypyridine-3-carboxamide is sourced from PubChem (CID 25121833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).