4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline

C15H24N2O2 — CID 106633476

IUPAC4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline
SMILESCOCCOc1ccc(NCC2CCCCN2)cc1
InChIInChI=1S/C15H24N2O2/c1-18-10-11-19-15-7-5-13(6-8-15)17-12-14-4-2-3-9-16-14/h5-8,14,16-17H,2-4,9-12H2,1H3
InChIKeyFJFOJEQPSUSQND-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.27
Rot. Bonds7

About 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline

4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline (PubChem CID 106633476) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline.

Molecular Properties

Compound Name4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline
PubChem CID106633476
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline
SMILESCOCCOc1ccc(NCC2CCCCN2)cc1
InChIInChI=1S/C15H24N2O2/c1-18-10-11-19-15-7-5-13(6-8-15)17-12-14-4-2-3-9-16-14/h5-8,14,16-17H,2-4,9-12H2,1H3
InChIKeyFJFOJEQPSUSQND-UHFFFAOYSA-N
XLogP2.27
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxyethoxy)-N-(pyrrolidin-2-ylmethyl)aniline
CID 106637941
4-cyclopentyloxy-N-(piperidin-2-ylmethyl)aniline
CID 106633330
N-[4-(2-methoxyethoxy)phenyl]-2-pyrrolidin-2-ylacetamide
CID 61366412
N-[4-(2-methoxyethoxy)phenyl]piperidine-2-carboxamide
CID 43713427
4-(2-fluoropropan-2-yl)-N-(piperidin-2-ylmethyl)aniline
CID 115054169
4-(1-fluoroethyl)-N-(piperidin-2-ylmethyl)aniline
CID 115041678
(2R)-2-[2-(4-ethoxyphenoxy)ethyl]piperidine
CID 28749865
6-methoxy-N-(pyrrolidin-2-ylmethyl)pyridin-3-amine
CID 106636193
N-(3,4-dihydro-2H-pyran-2-ylmethyl)-4-(2-methoxyethoxy)aniline
CID 55030880
methyl 4-(piperidin-2-ylmethylamino)pyridine-2-carboxylate
CID 66285496
methyl 2-chloro-5-(piperidin-2-ylmethylamino)benzoate
CID 106633173
4-cyclopentylsulfanyl-N-(piperidin-2-ylmethyl)aniline
CID 106633430

Frequently Asked Questions

What is the IUPAC name of 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline?
The IUPAC name of 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline (CID 106633476) is 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline.
What is the SMILES notation for 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline?
The canonical SMILES for 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline is COCCOc1ccc(NCC2CCCCN2)cc1.
What is the InChIKey of 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline?
The InChIKey is FJFOJEQPSUSQND-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-18-10-11-19-15-7-5-13(6-8-15)17-12-14-4-2-3-9-16-14/h5-8,14,16-17H,2-4,9-12H2,1H3.
What are the key properties of 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline?
4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline has a molecular weight of 264.37 g/mol, XLogP of 2.27, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyethoxy)-N-(piperidin-2-ylmethyl)aniline is sourced from PubChem (CID 106633476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).