[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol

C14H24N4O — CID 86331729

IUPAC[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
SMILESCCN(CC)c1cc(N2CCC[C@@H](CO)C2)ncn1
InChIInChI=1S/C14H24N4O/c1-3-17(4-2)13-8-14(16-11-15-13)18-7-5-6-12(9-18)10-19/h8,11-12,19H,3-7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyIKLWUYRZOJASRP-GFCCVEGCSA-N
MW264.37 g/mol
LogP1.53
Rot. Bonds5

About [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol

[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol (PubChem CID 86331729) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
PubChem CID86331729
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol
SMILESCCN(CC)c1cc(N2CCC[C@@H](CO)C2)ncn1
InChIInChI=1S/C14H24N4O/c1-3-17(4-2)13-8-14(16-11-15-13)18-7-5-6-12(9-18)10-19/h8,11-12,19H,3-7,9-10H2,1-2H3/t12-/m1/s1
InChIKeyIKLWUYRZOJASRP-GFCCVEGCSA-N
XLogP1.53
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-Propyl-1-(pyrimidin-2-ylmethyl)piperidin-3-yl]methanol
CID 70778823
[1-[6-[4-[2-(Dimethylamino)ethyl]piperidin-1-yl]pyrimidin-4-yl]pyrrolidin-2-yl]methanol
CID 72144597
1-{6-[(3R*,4R*)-3-cyclopropyl-3-hydroxy-4-methyl-1-pyrrolidinyl]-4-pyrimidinyl}-4-piperidinol
CID 72878549
[(3R*,4R*)-1-(2-amino-4-pyrimidinyl)-4-(1-piperidinylmethyl)-3-pyrrolidinyl]methanol
CID 72890329
[1-[(2-Propan-2-ylpyrimidin-5-yl)methyl]piperidin-3-yl]methanol
CID 73440666
[1-(6-Chloropyrimidin-4-yl)piperidin-3-yl]methanol
CID 22309478
[(3S*,5R*)-1-[6-(dimethylamino)-4-pyrimidinyl]-5-(4-morpholinylmethyl)-3-piperidinyl]methanol
CID 72850884
[2-(Pyrimidin-4-YL)-2,8-diazaspiro[4.5]decan-4-YL]methanol
CID 91910433
(1-(Pyrimidin-2-yl)piperidin-3-yl)methanol
CID 6456539
(3R*,4S*)-3,4-dimethyl-1-[6-(4-morpholinyl)-4-pyrimidinyl]-4-piperidinol
CID 72915704
[1-[6-[4-[(1-Methylpiperidin-2-yl)methyl]piperazin-1-yl]pyrimidin-4-yl]piperidin-3-yl]methanol
CID 75420084
4-N,6-N-dimethyl-4-N,6-N-bis(oxan-3-ylmethyl)pyrimidine-4,6-diamine
CID 75478883

Frequently Asked Questions

What is the IUPAC name of [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The IUPAC name of [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol (CID 86331729) is [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol.
What is the SMILES notation for [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The canonical SMILES for [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol is CCN(CC)c1cc(N2CCC[C@@H](CO)C2)ncn1.
What is the InChIKey of [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
The InChIKey is IKLWUYRZOJASRP-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H24N4O/c1-3-17(4-2)13-8-14(16-11-15-13)18-7-5-6-12(9-18)10-19/h8,11-12,19H,3-7,9-10H2,1-2H3/t12-/m1/s1.
What are the key properties of [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol?
[(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-1-[6-(diethylamino)pyrimidin-4-yl]piperidin-3-yl]methanol is sourced from PubChem (CID 86331729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).