4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol

C11H23NO2 — CID 64720380

IUPAC4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol
SMILESCOCCN(C(C)CC(C)O)C1CC1
InChIInChI=1S/C11H23NO2/c1-9(8-10(2)13)12(6-7-14-3)11-4-5-11/h9-11,13H,4-8H2,1-3H3
InChIKeyQKTQXINQGRHADX-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds7

About 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol

4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol (PubChem CID 64720380) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol.

Molecular Properties

Compound Name4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol
PubChem CID64720380
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol
SMILESCOCCN(C(C)CC(C)O)C1CC1
InChIInChI=1S/C11H23NO2/c1-9(8-10(2)13)12(6-7-14-3)11-4-5-11/h9-11,13H,4-8H2,1-3H3
InChIKeyQKTQXINQGRHADX-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol?
The IUPAC name of 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol (CID 64720380) is 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol.
What is the SMILES notation for 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol?
The canonical SMILES for 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol is COCCN(C(C)CC(C)O)C1CC1.
What is the InChIKey of 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol?
The InChIKey is QKTQXINQGRHADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-9(8-10(2)13)12(6-7-14-3)11-4-5-11/h9-11,13H,4-8H2,1-3H3.
What are the key properties of 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol?
4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclopropyl(2-methoxyethyl)amino]pentan-2-ol is sourced from PubChem (CID 64720380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).