4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine

C14H22N4O2 — CID 126434757

IUPAC4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine
SMILESCOC1CCN(c2cc([C@H]3CCOC3)nc(N)n2)CC1
InChIInChI=1S/C14H22N4O2/c1-19-11-2-5-18(6-3-11)13-8-12(16-14(15)17-13)10-4-7-20-9-10/h8,10-11H,2-7,9H2,1H3,(H2,15,16,17)/t10-/m0/s1
InChIKeyYLCUZPYEIQSILF-JTQLQIEISA-N
MW278.36 g/mol
LogP1.18
Rot. Bonds3

About 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine

4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine (PubChem CID 126434757) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine
PubChem CID126434757
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC Name4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine
SMILESCOC1CCN(c2cc([C@H]3CCOC3)nc(N)n2)CC1
InChIInChI=1S/C14H22N4O2/c1-19-11-2-5-18(6-3-11)13-8-12(16-14(15)17-13)10-4-7-20-9-10/h8,10-11H,2-7,9H2,1H3,(H2,15,16,17)/t10-/m0/s1
InChIKeyYLCUZPYEIQSILF-JTQLQIEISA-N
XLogP1.18
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-(2-{[6-(3-Hydroxycyclobutyl)-2-methylpyrimidin-4-YL]amino}ethyl)piperidin-4-OL
CID 91762966
N-ethyl-2-methyl-6-piperidin-4-yl-N-(tetrahydro-2H-pyran-4-ylmethyl)pyrimidin-4-amine
CID 56704383
(3S*,4R*)-1-(6-isopropyl-2-methylpyrimidin-4-yl)-3-methoxypiperidin-4-amine
CID 56878500
3-{6-[{[4-(hydroxymethyl)tetrahydro-2H-pyran-4-yl]methyl}(methyl)amino]-2-methylpyrimidin-4-yl}cyclobutanol
CID 91775506
(3R)-1-[2-amino-6-(cis-3-hydroxycyclobutyl)pyrimidin-4-yl]pyrrolidin-3-ol
CID 91782443
4-ethyl-N,N-dimethyl-6-[4-[[(2R)-2-methyloxolan-2-yl]methylamino]piperidin-1-yl]pyrimidin-2-amine
CID 97271688
4,4-Difluoro-1-({[2-methyl-6-(tetrahydrofuran-3-yl)pyrimidin-4-yl]amino}methyl)cyclohexanol
CID 118774207
N-methyl-N-[[2-(methylamino)pyrimidin-5-yl]methyl]-6-[(3R)-oxolan-3-yl]pyrimidin-4-amine
CID 125169943
2-[cyclohexyl-[6-[(3R)-oxolan-3-yl]pyrimidin-4-yl]amino]ethanol
CID 125171876
4-[2-(3-hydroxyazetidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-4-yl]piperazin-2-one
CID 125178368
4-N-methyl-6-[(3R)-oxolan-3-yl]-4-N-(pyrazin-2-ylmethyl)pyrimidine-2,4-diamine
CID 126423525
4-(azocan-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine
CID 126424927

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine?
The IUPAC name of 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine (CID 126434757) is 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine?
The canonical SMILES for 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine is COC1CCN(c2cc([C@H]3CCOC3)nc(N)n2)CC1.
What is the InChIKey of 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine?
The InChIKey is YLCUZPYEIQSILF-JTQLQIEISA-N. The full InChI is InChI=1S/C14H22N4O2/c1-19-11-2-5-18(6-3-11)13-8-12(16-14(15)17-13)10-4-7-20-9-10/h8,10-11H,2-7,9H2,1H3,(H2,15,16,17)/t10-/m0/s1.
What are the key properties of 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine?
4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine has a molecular weight of 278.36 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxypiperidin-1-yl)-6-[(3R)-oxolan-3-yl]pyrimidin-2-amine is sourced from PubChem (CID 126434757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).