2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol

C14H28N2O2 — CID 114221626

IUPAC2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol
SMILESCOC1CCN(CC(C)(CO)NC2CC2)C(C)C1
InChIInChI=1S/C14H28N2O2/c1-11-8-13(18-3)6-7-16(11)9-14(2,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyOGGFDWGPRSECPR-UHFFFAOYSA-N
MW256.39 g/mol
LogP0.99
Rot. Bonds6

About 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol

2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol (PubChem CID 114221626) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol
PubChem CID114221626
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol
SMILESCOC1CCN(CC(C)(CO)NC2CC2)C(C)C1
InChIInChI=1S/C14H28N2O2/c1-11-8-13(18-3)6-7-16(11)9-14(2,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3
InChIKeyOGGFDWGPRSECPR-UHFFFAOYSA-N
XLogP0.99
TPSA44.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-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

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol?
The IUPAC name of 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol (CID 114221626) is 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol?
The canonical SMILES for 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol is COC1CCN(CC(C)(CO)NC2CC2)C(C)C1.
What is the InChIKey of 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol?
The InChIKey is OGGFDWGPRSECPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-11-8-13(18-3)6-7-16(11)9-14(2,10-17)15-12-4-5-12/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol?
2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol has a molecular weight of 256.39 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-3-(4-methoxy-2-methylpiperidin-1-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 114221626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).