2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol

C12H18N2O2 — CID 106504158

IUPAC2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol
SMILESCOc1ccc(NCC2CCCC2O)nc1
InChIInChI=1S/C12H18N2O2/c1-16-10-5-6-12(14-8-10)13-7-9-3-2-4-11(9)15/h5-6,8-9,11,15H,2-4,7H2,1H3,(H,13,14)
InChIKeyCLSXZBRZKOQDJH-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.66
Rot. Bonds4

About 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol

2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol (PubChem CID 106504158) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol
PubChem CID106504158
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol
SMILESCOc1ccc(NCC2CCCC2O)nc1
InChIInChI=1S/C12H18N2O2/c1-16-10-5-6-12(14-8-10)13-7-9-3-2-4-11(9)15/h5-6,8-9,11,15H,2-4,7H2,1H3,(H,13,14)
InChIKeyCLSXZBRZKOQDJH-UHFFFAOYSA-N
XLogP1.66
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2-hydroxycyclopentyl)methylamino]-N-propylpyridine-3-carboxamide
CID 133324037
1-cyclopropyl-2-[(5-methoxy-2-pyridinyl)amino]ethanol
CID 106504104
2-[[(6-methoxyisoquinolin-1-yl)amino]methyl]cyclohexan-1-ol
CID 106538839
2-[[(6-methoxy-2-methylpyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 66326314
[2-[[(5-tert-butyl-2-pyridinyl)amino]methyl]cyclopentyl]methanol
CID 107874762
N-cyclopropyl-5-methoxypyridin-2-amine
CID 106503930
2-[6-[(2-hydroxycyclopentyl)methylamino]-3-pyridinyl]-4,5-dimethyl-1H-pyrimidin-6-one
CID 137275514
2-[[(4-methoxyphenyl)methylamino]methyl]cyclohexan-1-ol
CID 64927668
2-hydroxy-N-[(2-hydroxycyclohexyl)methyl]-5-methoxybenzamide
CID 64911532
5-methoxy-N-[2-(4-methylcyclohexyl)ethyl]pyridin-2-amine
CID 106504121
2-[[(2-aminopyrimidin-4-yl)amino]methyl]cyclopentan-1-ol
CID 80856454
N-cyclopropyl-N'-(5-methoxy-2-pyridinyl)propane-1,3-diamine
CID 106504375

Frequently Asked Questions

What is the IUPAC name of 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol (CID 106504158) is 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol is COc1ccc(NCC2CCCC2O)nc1.
What is the InChIKey of 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is CLSXZBRZKOQDJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-16-10-5-6-12(14-8-10)13-7-9-3-2-4-11(9)15/h5-6,8-9,11,15H,2-4,7H2,1H3,(H,13,14).
What are the key properties of 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol?
2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 222.29 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(5-methoxy-2-pyridinyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 106504158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).