2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol

C14H31NO3 — CID 106810377

IUPAC2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol
SMILESCCNC(CC)(CO)CCCOCCOC(C)C
InChIInChI=1S/C14H31NO3/c1-5-14(12-16,15-6-2)8-7-9-17-10-11-18-13(3)4/h13,15-16H,5-12H2,1-4H3
InChIKeySMVYQBRSETXYNG-UHFFFAOYSA-N
MW261.41 g/mol
LogP1.96
Rot. Bonds12

About 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol

2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol (PubChem CID 106810377) has the molecular formula C14H31NO3 and a molecular weight of 261.41 g/mol. Its IUPAC name is 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol.

Molecular Properties

Compound Name2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol
PubChem CID106810377
Molecular FormulaC14H31NO3
Molecular Weight261.41 g/mol
Exact Mass261.23
IUPAC Name2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol
SMILESCCNC(CC)(CO)CCCOCCOC(C)C
InChIInChI=1S/C14H31NO3/c1-5-14(12-16,15-6-2)8-7-9-17-10-11-18-13(3)4/h13,15-16H,5-12H2,1-4H3
InChIKeySMVYQBRSETXYNG-UHFFFAOYSA-N
XLogP1.96
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol 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-ethyl-2-(ethylamino)-5-(4-methylpentoxy)pentan-1-ol
CID 106810296
5-butan-2-yloxy-2-ethyl-2-(ethylamino)pentan-1-ol
CID 106810599
2-(ethylamino)-2-methyl-5-(2-propan-2-yloxyethoxy)pentan-1-ol
CID 64805300
2-ethyl-2-(ethylamino)-5-(1-methoxypropan-2-yloxy)pentan-1-ol
CID 106810166
2-ethyl-5-heptoxy-2-(propan-2-ylamino)pentan-1-ol
CID 106810270
2-ethyl-2-(ethylamino)-5-(oxan-4-ylmethoxy)pentan-1-ol
CID 106810155
2-methyl-2-(propan-2-ylamino)-6-(2-propan-2-yloxyethoxy)hexan-1-ol
CID 64805299
4,4-dimethyl-1-[2-(2-propan-2-yloxyethoxy)ethoxy]pentane
CID 176777068
5-butan-2-yloxy-2-ethyl-2-(propan-2-ylamino)pentan-1-ol
CID 106810597
2-ethyl-2-(ethylamino)-5-(2-methylcyclohexyl)oxypentan-1-ol
CID 106810329
2-ethyl-2-(methylamino)-5-pentoxypentan-1-ol
CID 106810584
5-[bis(2-methylpropyl)amino]-2-ethyl-2-(ethylamino)pentan-1-ol
CID 106809363

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol?
The IUPAC name of 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol (CID 106810377) is 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol.
What is the SMILES notation for 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol?
The canonical SMILES for 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol is CCNC(CC)(CO)CCCOCCOC(C)C.
What is the InChIKey of 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol?
The InChIKey is SMVYQBRSETXYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31NO3/c1-5-14(12-16,15-6-2)8-7-9-17-10-11-18-13(3)4/h13,15-16H,5-12H2,1-4H3.
What are the key properties of 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol?
2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol has a molecular weight of 261.41 g/mol, XLogP of 1.96, 12 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(ethylamino)-5-(2-propan-2-yloxyethoxy)pentan-1-ol is sourced from PubChem (CID 106810377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).