2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol

C13H20N2O — CID 79267879

IUPAC2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cccc(CNCC2CCCC2O)n1
InChIInChI=1S/C13H20N2O/c1-10-4-2-6-12(15-10)9-14-8-11-5-3-7-13(11)16/h2,4,6,11,13-14,16H,3,5,7-9H2,1H3
InChIKeyWPEMOKGZFKRVON-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.64
Rot. Bonds4

About 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol

2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol (PubChem CID 79267879) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
PubChem CID79267879
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol
SMILESCc1cccc(CNCC2CCCC2O)n1
InChIInChI=1S/C13H20N2O/c1-10-4-2-6-12(15-10)9-14-8-11-5-3-7-13(11)16/h2,4,6,11,13-14,16H,3,5,7-9H2,1H3
InChIKeyWPEMOKGZFKRVON-UHFFFAOYSA-N
XLogP1.64
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol (CID 79267879) is 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol is Cc1cccc(CNCC2CCCC2O)n1.
What is the InChIKey of 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol?
The InChIKey is WPEMOKGZFKRVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-10-4-2-6-12(15-10)9-14-8-11-5-3-7-13(11)16/h2,4,6,11,13-14,16H,3,5,7-9H2,1H3.
What are the key properties of 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol?
2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol has a molecular weight of 220.32 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(6-methyl-2-pyridinyl)methylamino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 79267879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).