[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol

C12H20N4O — CID 114179859

IUPAC[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol
SMILESCNc1cc(NC2CCCC2CO)nc(C)n1
InChIInChI=1S/C12H20N4O/c1-8-14-11(13-2)6-12(15-8)16-10-5-3-4-9(10)7-17/h6,9-10,17H,3-5,7H2,1-2H3,(H2,13,14,15,16)
InChIKeyQEFVPIZIVXGNDA-UHFFFAOYSA-N
MW236.32 g/mol
LogP1.40
Rot. Bonds4

About [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol

[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol (PubChem CID 114179859) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol.

Molecular Properties

Compound Name[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol
PubChem CID114179859
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC Name[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol
SMILESCNc1cc(NC2CCCC2CO)nc(C)n1
InChIInChI=1S/C12H20N4O/c1-8-14-11(13-2)6-12(15-8)16-10-5-3-4-9(10)7-17/h6,9-10,17H,3-5,7H2,1-2H3,(H2,13,14,15,16)
InChIKeyQEFVPIZIVXGNDA-UHFFFAOYSA-N
XLogP1.40
TPSA70.07 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 51.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclohexyl]methanol
CID 106368257
4-N-(2-ethylcyclohexyl)-6-N,2-dimethylpyrimidine-4,6-diamine
CID 80803646
[2-[(6-ethyl-2-methylpyrimidin-4-yl)amino]cycloheptyl]methanol
CID 133472380
[2-[[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]methyl]cyclohexyl]methanol
CID 80856232
[2-[(6-amino-2-ethylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 104924452
[2-[(2-ethyl-6-hydrazinylpyrimidin-4-yl)amino]cyclohexyl]methanol
CID 106368406
[2-[(6-bromo-2-ethylpyrimidin-4-yl)amino]cyclopentyl]methanol
CID 106364093
[2-[[6-(ethylamino)-2-(methoxymethyl)pyrimidin-4-yl]amino]cyclopentyl]methanol
CID 106367984
2-tert-butyl-6-[[2-(hydroxymethyl)cyclopentyl]amino]pyridine-4-carboxylic acid
CID 106361779
[(1R,2R)-2-[(3-methyl-1,2,4-thiadiazol-5-yl)amino]cyclopentyl]methanol
CID 99846980
[2-[(2-methyl-4-pyridinyl)amino]cyclopentyl]methanol
CID 104924451
[(1R,2R)-2-[[2-(methoxymethyl)-6-methylpyrimidin-4-yl]amino]cycloheptyl]methanol
CID 97223315

Frequently Asked Questions

What is the IUPAC name of [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The IUPAC name of [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol (CID 114179859) is [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol.
What is the SMILES notation for [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The canonical SMILES for [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol is CNc1cc(NC2CCCC2CO)nc(C)n1.
What is the InChIKey of [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol?
The InChIKey is QEFVPIZIVXGNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O/c1-8-14-11(13-2)6-12(15-8)16-10-5-3-4-9(10)7-17/h6,9-10,17H,3-5,7H2,1-2H3,(H2,13,14,15,16).
What are the key properties of [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol?
[2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol has a molecular weight of 236.32 g/mol, XLogP of 1.40, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-methyl-6-(methylamino)pyrimidin-4-yl]amino]cyclopentyl]methanol is sourced from PubChem (CID 114179859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).