2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol

C14H28N2O — CID 64796814

IUPAC2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol
SMILESCCCN(CC)CC(CO)(NC1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-3-9-16(4-2)10-14(11-17,12-5-6-12)15-13-7-8-13/h12-13,15,17H,3-11H2,1-2H3
InChIKeyOLHITEALFSSZIS-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds9

About 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol

2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol (PubChem CID 64796814) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol
PubChem CID64796814
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol
SMILESCCCN(CC)CC(CO)(NC1CC1)C1CC1
InChIInChI=1S/C14H28N2O/c1-3-9-16(4-2)10-14(11-17,12-5-6-12)15-13-7-8-13/h12-13,15,17H,3-11H2,1-2H3
InChIKeyOLHITEALFSSZIS-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol (CID 64796814) is 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol is CCCN(CC)CC(CO)(NC1CC1)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol?
The InChIKey is OLHITEALFSSZIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-9-16(4-2)10-14(11-17,12-5-6-12)15-13-7-8-13/h12-13,15,17H,3-11H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol?
2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)-3-[ethyl(propyl)amino]propan-1-ol is sourced from PubChem (CID 64796814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).