(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol

C15H24N4O — CID 92567647

IUPAC(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(Cc2cnc(N3CCCCC3)nc2)C1
InChIInChI=1S/C15H24N4O/c20-14-5-4-6-18(12-14)11-13-9-16-15(17-10-13)19-7-2-1-3-8-19/h9-10,14,20H,1-8,11-12H2/t14-/m1/s1
InChIKeyZTCUQHBRVJZDHX-CQSZACIVSA-N
MW276.38 g/mol
LogP1.42
Rot. Bonds3

About (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol

(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol (PubChem CID 92567647) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol
PubChem CID92567647
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol
SMILESO[C@@H]1CCCN(Cc2cnc(N3CCCCC3)nc2)C1
InChIInChI=1S/C15H24N4O/c20-14-5-4-6-18(12-14)11-13-9-16-15(17-10-13)19-7-2-1-3-8-19/h9-10,14,20H,1-8,11-12H2/t14-/m1/s1
InChIKeyZTCUQHBRVJZDHX-CQSZACIVSA-N
XLogP1.42
TPSA52.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol with MolForge

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Related Compounds

1-[(6-amino-3-pyridinyl)methyl]piperidin-3-ol
CID 62207915
3-[[3-[(2-piperidin-1-ylpyrimidin-5-yl)methylamino]piperidin-1-yl]methyl]phenol
CID 131946815
(3S)-1-[(6-tert-butyl-3-pyridinyl)methyl]piperidin-3-ol
CID 134595793
2-[5-[1-[(2-pyrrolidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-yl]pyrazol-1-yl]acetic acid
CID 119061839
4-ethyl-3-[1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-yl]-1H-1,2,4-triazol-5-one
CID 56710335
(3S)-1-[(3,5-difluorophenyl)methyl]piperidin-3-ol
CID 107225646
(3R)-1-benzylazepan-3-ol
CID 124585423
5-[[3-(pyridin-2-ylmethoxy)piperidin-1-yl]methyl]-2-pyrrolidin-1-ylpyrimidine
CID 56906695
4-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]-1,4-thiazinane 1,1-dioxide
CID 77080425
1-[(2,6-dichloro-4-pyridinyl)methyl]piperidin-3-ol
CID 110904761
1-[5-[4-(piperazin-1-ylmethyl)phenyl]pyrimidin-2-yl]piperidin-3-ol
CID 167796752
(3S)-1-[(4-ethylphenyl)methyl]piperidin-3-ol
CID 27055523

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol?
The IUPAC name of (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol (CID 92567647) is (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol.
What is the SMILES notation for (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol?
The canonical SMILES for (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol is O[C@@H]1CCCN(Cc2cnc(N3CCCCC3)nc2)C1.
What is the InChIKey of (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol?
The InChIKey is ZTCUQHBRVJZDHX-CQSZACIVSA-N. The full InChI is InChI=1S/C15H24N4O/c20-14-5-4-6-18(12-14)11-13-9-16-15(17-10-13)19-7-2-1-3-8-19/h9-10,14,20H,1-8,11-12H2/t14-/m1/s1.
What are the key properties of (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol?
(3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol has a molecular weight of 276.38 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(2-piperidin-1-ylpyrimidin-5-yl)methyl]piperidin-3-ol is sourced from PubChem (CID 92567647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).