2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole

C14H19N3O — CID 133410263

IUPAC2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole
SMILESCOCC1CCN(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C14H19N3O/c1-18-10-11-6-8-17(9-7-11)14-15-12-4-2-3-5-13(12)16-14/h2-5,11H,6-10H2,1H3,(H,15,16)
InChIKeySFIPAGQHDZFRJM-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.43
Rot. Bonds3

About 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole

2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole (PubChem CID 133410263) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole
PubChem CID133410263
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC Name2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole
SMILESCOCC1CCN(c2nc3ccccc3[nH]2)CC1
InChIInChI=1S/C14H19N3O/c1-18-10-11-6-8-17(9-7-11)14-15-12-4-2-3-5-13(12)16-14/h2-5,11H,6-10H2,1H3,(H,15,16)
InChIKeySFIPAGQHDZFRJM-UHFFFAOYSA-N
XLogP2.43
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole 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

2-[4-(cyclopentylmethoxy)piperidin-1-yl]-1H-benzimidazole
CID 133410848
2-[4-(trifluoromethyl)piperidin-1-yl]-1H-benzimidazole
CID 155941941
2-[(2S,4R)-4-methoxy-2-(methoxymethyl)pyrrolidin-1-yl]-1H-benzimidazole
CID 128978161
1-(1H-benzimidazol-2-yl)pyrrolidine-3-carboxylic acid
CID 120963990
2-[4-(2-methyl-1,3-dioxolan-2-yl)piperidin-1-yl]-1H-benzimidazole
CID 75435540
bis(2-(4-ethylpiperazin-1-yl)-1H-benzimidazole);hydrate;tetrahydrochloride
CID 67157381
2-[(3S)-3-methylpiperidin-1-yl]-1H-benzimidazole
CID 94217972
2-(3-phenylpyrrolidin-1-yl)-1H-benzimidazole
CID 133409902
1-[1-(1H-benzimidazol-2-yl)pyrrolidin-3-yl]ethanol
CID 112627764
[1-(1H-benzimidazol-2-yl)piperidin-4-yl] N-tert-butyl-N-methylcarbamate
CID 54562997
2-(4-methyl-1,4-diazepan-1-yl)-1H-benzimidazole
CID 10704647
1-[4-(1H-benzimidazol-2-yl)piperazin-1-yl]ethanone
CID 110376496

Frequently Asked Questions

What is the IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole?
The IUPAC name of 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole (CID 133410263) is 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole.
What is the SMILES notation for 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole?
The canonical SMILES for 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole is COCC1CCN(c2nc3ccccc3[nH]2)CC1.
What is the InChIKey of 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole?
The InChIKey is SFIPAGQHDZFRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-18-10-11-6-8-17(9-7-11)14-15-12-4-2-3-5-13(12)16-14/h2-5,11H,6-10H2,1H3,(H,15,16).
What are the key properties of 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole?
2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole has a molecular weight of 245.33 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(methoxymethyl)piperidin-1-yl]-1H-benzimidazole is sourced from PubChem (CID 133410263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).