1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol

C11H17N3O — CID 75431497

IUPAC1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
SMILESCN(CC1(O)CCCC1)c1ncccn1
InChIInChI=1S/C11H17N3O/c1-14(10-12-7-4-8-13-10)9-11(15)5-2-3-6-11/h4,7-8,15H,2-3,5-6,9H2,1H3
InChIKeyQUAZHRAZLVOLHN-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.22
Rot. Bonds3

About 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol

1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol (PubChem CID 75431497) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
PubChem CID75431497
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol
SMILESCN(CC1(O)CCCC1)c1ncccn1
InChIInChI=1S/C11H17N3O/c1-14(10-12-7-4-8-13-10)9-11(15)5-2-3-6-11/h4,7-8,15H,2-3,5-6,9H2,1H3
InChIKeyQUAZHRAZLVOLHN-UHFFFAOYSA-N
XLogP1.22
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol (CID 75431497) is 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol is CN(CC1(O)CCCC1)c1ncccn1.
What is the InChIKey of 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol?
The InChIKey is QUAZHRAZLVOLHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14(10-12-7-4-8-13-10)9-11(15)5-2-3-6-11/h4,7-8,15H,2-3,5-6,9H2,1H3.
What are the key properties of 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol?
1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol has a molecular weight of 207.28 g/mol, XLogP of 1.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[methyl(pyrimidin-2-yl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 75431497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).