[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol

C14H22N2O2 — CID 106660625

IUPAC[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCOc1cnc(C)cc1NCC1(CO)CCCC1
InChIInChI=1S/C14H22N2O2/c1-11-7-12(13(18-2)8-15-11)16-9-14(10-17)5-3-4-6-14/h7-8,17H,3-6,9-10H2,1-2H3,(H,15,16)
InChIKeyYKSVSRUWZWDWML-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.36
Rot. Bonds5

About [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol

[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol (PubChem CID 106660625) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol.

Molecular Properties

Compound Name[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol
PubChem CID106660625
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol
SMILESCOc1cnc(C)cc1NCC1(CO)CCCC1
InChIInChI=1S/C14H22N2O2/c1-11-7-12(13(18-2)8-15-11)16-9-14(10-17)5-3-4-6-14/h7-8,17H,3-6,9-10H2,1-2H3,(H,15,16)
InChIKeyYKSVSRUWZWDWML-UHFFFAOYSA-N
XLogP2.36
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol?
The IUPAC name of [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol (CID 106660625) is [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol.
What is the SMILES notation for [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol?
The canonical SMILES for [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol is COc1cnc(C)cc1NCC1(CO)CCCC1.
What is the InChIKey of [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol?
The InChIKey is YKSVSRUWZWDWML-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-11-7-12(13(18-2)8-15-11)16-9-14(10-17)5-3-4-6-14/h7-8,17H,3-6,9-10H2,1-2H3,(H,15,16).
What are the key properties of [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol?
[1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol has a molecular weight of 250.34 g/mol, XLogP of 2.36, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[(5-methoxy-2-methyl-4-pyridinyl)amino]methyl]cyclopentyl]methanol is sourced from PubChem (CID 106660625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).