4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine

C15H28N4O2 — CID 154684233

IUPAC4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
SMILESCCOCCOC1CCN(Cc2cn(C(C)C)nn2)CC1
InChIInChI=1S/C15H28N4O2/c1-4-20-9-10-21-15-5-7-18(8-6-15)11-14-12-19(13(2)3)17-16-14/h12-13,15H,4-11H2,1-3H3
InChIKeyFTYQGJOGPDSBEL-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.88
Rot. Bonds8

About 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine

4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine (PubChem CID 154684233) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine.

Molecular Properties

Compound Name4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
PubChem CID154684233
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC Name4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
SMILESCCOCCOC1CCN(Cc2cn(C(C)C)nn2)CC1
InChIInChI=1S/C15H28N4O2/c1-4-20-9-10-21-15-5-7-18(8-6-15)11-14-12-19(13(2)3)17-16-14/h12-13,15H,4-11H2,1-3H3
InChIKeyFTYQGJOGPDSBEL-UHFFFAOYSA-N
XLogP1.88
TPSA52.41 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1-[4-(Morpholin-4-ylmethyl)triazol-1-yl]hexan-2-ol
CID 46863383
4-methoxy-1-[(1-methyl-1H-1,2,3-triazol-4-yl)methyl]-4-(trifluoromethyl)piperidine
CID 171994299
1-[(1-Methyltriazol-4-yl)methyl]piperidine
CID 54569606
4-(4-Methyltriazol-1-yl)-1-(oxetan-3-yl)piperidine
CID 124189041
1-(2-Methoxyethyl)-4-(4-methyltriazol-1-yl)piperidine
CID 124189254
4-[(1-methyl-1H-1,2,3-triazol-4-yl)methyl]morpholine
CID 130163626
Ethane;4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
CID 154684232
Ethane;4-(2-propan-2-yloxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
CID 154684238
Ethane;4-(2-methoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
CID 154684282
Ethane;4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine
CID 154684294
4-Methoxy-1-[(1-methyltriazol-4-yl)methyl]piperidine
CID 154684345
1-[(1-Ethyltriazol-4-yl)methyl]-4-methoxypiperidine
CID 154684353

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine?
The IUPAC name of 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine (CID 154684233) is 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine.
What is the SMILES notation for 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine?
The canonical SMILES for 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine is CCOCCOC1CCN(Cc2cn(C(C)C)nn2)CC1.
What is the InChIKey of 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine?
The InChIKey is FTYQGJOGPDSBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-4-20-9-10-21-15-5-7-18(8-6-15)11-14-12-19(13(2)3)17-16-14/h12-13,15H,4-11H2,1-3H3.
What are the key properties of 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine?
4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine has a molecular weight of 296.42 g/mol, XLogP of 1.88, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethoxyethoxy)-1-[(1-propan-2-yltriazol-4-yl)methyl]piperidine is sourced from PubChem (CID 154684233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).