2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol

C15H24N4O — CID 171359339

IUPAC2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol
SMILESCC1CCCN(c2cc(NC3CCCC3O)ncn2)C1
InChIInChI=1S/C15H24N4O/c1-11-4-3-7-19(9-11)15-8-14(16-10-17-15)18-12-5-2-6-13(12)20/h8,10-13,20H,2-7,9H2,1H3,(H,16,17,18)
InChIKeyCGIHALGCUVKCGZ-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.04
Rot. Bonds3

About 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol

2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol (PubChem CID 171359339) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol
PubChem CID171359339
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol
SMILESCC1CCCN(c2cc(NC3CCCC3O)ncn2)C1
InChIInChI=1S/C15H24N4O/c1-11-4-3-7-19(9-11)15-8-14(16-10-17-15)18-12-5-2-6-13(12)20/h8,10-13,20H,2-7,9H2,1H3,(H,16,17,18)
InChIKeyCGIHALGCUVKCGZ-UHFFFAOYSA-N
XLogP2.04
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol?
The IUPAC name of 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol (CID 171359339) is 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol.
What is the SMILES notation for 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol?
The canonical SMILES for 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol is CC1CCCN(c2cc(NC3CCCC3O)ncn2)C1.
What is the InChIKey of 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol?
The InChIKey is CGIHALGCUVKCGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-11-4-3-7-19(9-11)15-8-14(16-10-17-15)18-12-5-2-6-13(12)20/h8,10-13,20H,2-7,9H2,1H3,(H,16,17,18).
What are the key properties of 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol?
2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol has a molecular weight of 276.38 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(3-methylpiperidin-1-yl)pyrimidin-4-yl]amino]cyclopentan-1-ol is sourced from PubChem (CID 171359339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).