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

C12H18N2O — CID 104924451

IUPAC[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol
SMILESCc1cc(NC2CCCC2CO)ccn1
InChIInChI=1S/C12H18N2O/c1-9-7-11(5-6-13-9)14-12-4-2-3-10(12)8-15/h5-7,10,12,15H,2-4,8H2,1H3,(H,13,14)
InChIKeyVBHJSVJQHUXKTK-UHFFFAOYSA-N
MW206.29 g/mol
LogP1.96
Rot. Bonds3

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

[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol (PubChem CID 104924451) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol
PubChem CID104924451
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol
SMILESCc1cc(NC2CCCC2CO)ccn1
InChIInChI=1S/C12H18N2O/c1-9-7-11(5-6-13-9)14-12-4-2-3-10(12)8-15/h5-7,10,12,15H,2-4,8H2,1H3,(H,13,14)
InChIKeyVBHJSVJQHUXKTK-UHFFFAOYSA-N
XLogP1.96
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[(1R,2R)-2-[(2-methyl-4-pyridinyl)amino]cyclopropyl]methanol
CID 130719040
[2-[(2-hydrazinyl-4-pyridinyl)amino]cyclopentyl]methanol
CID 106368372
2-methyl-N-(2-methylsulfanylcyclohexyl)pyridin-4-amine
CID 104924401
[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol
CID 114179859
[2-[(5-amino-3-pyridinyl)amino]cyclopentyl]methanol
CID 106368070
[2-[(2-hydrazinylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 106368360
[2-(pyridin-2-ylamino)cyclohexyl]methanol
CID 106362177
[(1R,2R)-2-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol
CID 99846980
4-[(2-ethylcyclohexyl)amino]pyridine-2-carbonitrile
CID 62926226
N-[2-(chloromethyl)cyclohexyl]-2-methoxypyridin-4-amine
CID 106365699
[2-(3-nitroanilino)cyclopentyl]methanol
CID 103703697
[2-[(3-methoxy-2-pyridinyl)amino]cyclopentyl]methanol
CID 106362135

Frequently Asked Questions

What is the IUPAC name of [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol?
The IUPAC name of [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol (CID 104924451) is [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol?
The canonical SMILES for [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol is Cc1cc(NC2CCCC2CO)ccn1.
What is the InChIKey of [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol?
The InChIKey is VBHJSVJQHUXKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O/c1-9-7-11(5-6-13-9)14-12-4-2-3-10(12)8-15/h5-7,10,12,15H,2-4,8H2,1H3,(H,13,14).
What are the key properties of [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol?
[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol has a molecular weight of 206.29 g/mol, XLogP of 1.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol is sourced from PubChem (CID 104924451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).