piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol

C17H24N2O2 — CID 83164729

IUPACpiperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol
SMILESCCCOc1cccc2[nH]cc(C(O)C3CCNCC3)c12
InChIInChI=1S/C17H24N2O2/c1-2-10-21-15-5-3-4-14-16(15)13(11-19-14)17(20)12-6-8-18-9-7-12/h3-5,11-12,17-20H,2,6-10H2,1H3
InChIKeyCDYGVNKRRNLXCW-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.99
Rot. Bonds5

About piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol

piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol (PubChem CID 83164729) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol.

Molecular Properties

Compound Namepiperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol
PubChem CID83164729
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Namepiperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol
SMILESCCCOc1cccc2[nH]cc(C(O)C3CCNCC3)c12
InChIInChI=1S/C17H24N2O2/c1-2-10-21-15-5-3-4-14-16(15)13(11-19-14)17(20)12-6-8-18-9-7-12/h3-5,11-12,17-20H,2,6-10H2,1H3
InChIKeyCDYGVNKRRNLXCW-UHFFFAOYSA-N
XLogP2.99
TPSA57.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol 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 piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol?
The IUPAC name of piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol (CID 83164729) is piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol.
What is the SMILES notation for piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol?
The canonical SMILES for piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol is CCCOc1cccc2[nH]cc(C(O)C3CCNCC3)c12.
What is the InChIKey of piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol?
The InChIKey is CDYGVNKRRNLXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-2-10-21-15-5-3-4-14-16(15)13(11-19-14)17(20)12-6-8-18-9-7-12/h3-5,11-12,17-20H,2,6-10H2,1H3.
What are the key properties of piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol?
piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol has a molecular weight of 288.39 g/mol, XLogP of 2.99, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for piperidin-4-yl-(4-propoxy-1H-indol-3-yl)methanol is sourced from PubChem (CID 83164729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).