(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol

C10H15FN4O — CID 138511172

IUPAC(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2ncnc(N)c2F)CC[C@H]1O
InChIInChI=1S/C10H15FN4O/c1-6-4-15(3-2-7(6)16)10-8(11)9(12)13-5-14-10/h5-7,16H,2-4H2,1H3,(H2,12,13,14)/t6?,7-/m1/s1
InChIKeyAXFYJWOHLVVSSX-COBSHVIPSA-N
MW226.25 g/mol
LogP0.41
Rot. Bonds1

About (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol

(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol (PubChem CID 138511172) has the molecular formula C10H15FN4O and a molecular weight of 226.25 g/mol. Its IUPAC name is (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol.

Molecular Properties

Compound Name(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol
PubChem CID138511172
Molecular FormulaC10H15FN4O
Molecular Weight226.25 g/mol
Exact Mass226.12
IUPAC Name(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol
SMILESCC1CN(c2ncnc(N)c2F)CC[C@H]1O
InChIInChI=1S/C10H15FN4O/c1-6-4-15(3-2-7(6)16)10-8(11)9(12)13-5-14-10/h5-7,16H,2-4H2,1H3,(H2,12,13,14)/t6?,7-/m1/s1
InChIKeyAXFYJWOHLVVSSX-COBSHVIPSA-N
XLogP0.41
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-1-(6-amino-5-fluoropyrimidin-4-yl)piperidin-4-ol
CID 123328215
1-(6-amino-5-methoxypyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 114683932
1-(6-amino-5-propan-2-ylpyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 114683982
5-fluoro-6-[(3R)-3-methylpiperidin-1-yl]pyrimidin-4-amine
CID 138511335
1-(6-aminoquinazolin-4-yl)-3-methylpiperidin-4-ol
CID 114677655
5-chloro-6-(3,4-dimethylpiperidin-1-yl)pyrimidin-4-amine
CID 106812346
1-(5-chloropyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 105370258
(3R,4R)-1-(3-amino-2-pyridinyl)-3-methylpiperidin-4-ol
CID 129445700
(3R)-1-[(3S,4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-4-fluoropiperidin-3-yl]-3-methylpiperidin-2-one
CID 138511350
1-(3-amino-5-methyl-2-pyridinyl)-3-methylpiperidin-4-ol
CID 114677696
(3R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-[[(1S)-1-phenylethyl]amino]piperidine-4-carboxylic acid
CID 118116588
1-(6-hydrazinyl-5-propylpyrimidin-4-yl)-3-methylpiperidin-4-ol
CID 114684050

Frequently Asked Questions

What is the IUPAC name of (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol?
The IUPAC name of (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol (CID 138511172) is (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol.
What is the SMILES notation for (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol?
The canonical SMILES for (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol is CC1CN(c2ncnc(N)c2F)CC[C@H]1O.
What is the InChIKey of (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol?
The InChIKey is AXFYJWOHLVVSSX-COBSHVIPSA-N. The full InChI is InChI=1S/C10H15FN4O/c1-6-4-15(3-2-7(6)16)10-8(11)9(12)13-5-14-10/h5-7,16H,2-4H2,1H3,(H2,12,13,14)/t6?,7-/m1/s1.
What are the key properties of (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol?
(4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol has a molecular weight of 226.25 g/mol, XLogP of 0.41, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(6-amino-5-fluoropyrimidin-4-yl)-3-methylpiperidin-4-ol is sourced from PubChem (CID 138511172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).