1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol

C17H29N5O2 — CID 72839277

IUPAC1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol
SMILESCC(C)Oc1cc(N2CCC(N3CCC(O)CC3)CC2)nc(N)n1
InChIInChI=1S/C17H29N5O2/c1-12(2)24-16-11-15(19-17(18)20-16)22-7-3-13(4-8-22)21-9-5-14(23)6-10-21/h11-14,23H,3-10H2,1-2H3,(H2,18,19,20)
InChIKeyVRECSIVUQGTCRC-UHFFFAOYSA-N
MW335.45 g/mol
LogP1.27
Rot. Bonds4

About 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol

1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol (PubChem CID 72839277) has the molecular formula C17H29N5O2 and a molecular weight of 335.45 g/mol. Its IUPAC name is 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol
PubChem CID72839277
Molecular FormulaC17H29N5O2
Molecular Weight335.45 g/mol
Exact Mass335.23
IUPAC Name1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol
SMILESCC(C)Oc1cc(N2CCC(N3CCC(O)CC3)CC2)nc(N)n1
InChIInChI=1S/C17H29N5O2/c1-12(2)24-16-11-15(19-17(18)20-16)22-7-3-13(4-8-22)21-9-5-14(23)6-10-21/h11-14,23H,3-10H2,1-2H3,(H2,18,19,20)
InChIKeyVRECSIVUQGTCRC-UHFFFAOYSA-N
XLogP1.27
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol with MolForge

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Related Compounds

(3R)-1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)pyrrolidin-3-ol
CID 50968139
(1S,3R)-7-(2-amino-6-propan-2-yloxypyrimidin-4-yl)-7-azaspiro[3.5]nonane-1,3-diol
CID 72858530
N-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]methanesulfonamide
CID 50982057
4-[4-(1-azabicyclo[2.2.2]octan-3-yl)piperazin-1-yl]-6-propan-2-yloxypyrimidin-2-amine
CID 72897316
1-(2-amino-6-methylpyrimidin-4-yl)piperidin-4-ol
CID 112724371
4-(4-piperidin-1-ylsulfonyl-1,4-diazepan-1-yl)-6-propan-2-yloxypyrimidin-2-amine
CID 134696150
3-amino-6-(4-hydroxypiperidin-1-yl)-4-propan-2-yloxythieno[2,3-b]pyridine-2-carboxamide
CID 10450537
1-(2-amino-6-chloropyrimidin-4-yl)pyrrolidin-3-ol
CID 72687128
2-[[2-amino-6-(4-piperidin-1-ylpiperidin-1-yl)pyrimidin-4-yl]amino]ethanol
CID 50948345
1-[2-amino-6-(4-methylsulfonylphenyl)pyrimidin-4-yl]piperidin-4-ol
CID 141280230
4-methoxy-6-(4-piperidin-4-ylpiperidin-1-yl)pyrimidin-2-amine
CID 146044412
(5S)-2-(2-amino-6-propan-2-yloxypyrimidin-4-yl)-2,7-diazaspiro[4.5]decan-6-one
CID 97131242

Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol?
The IUPAC name of 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol (CID 72839277) is 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol.
What is the SMILES notation for 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol?
The canonical SMILES for 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol is CC(C)Oc1cc(N2CCC(N3CCC(O)CC3)CC2)nc(N)n1.
What is the InChIKey of 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol?
The InChIKey is VRECSIVUQGTCRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29N5O2/c1-12(2)24-16-11-15(19-17(18)20-16)22-7-3-13(4-8-22)21-9-5-14(23)6-10-21/h11-14,23H,3-10H2,1-2H3,(H2,18,19,20).
What are the key properties of 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol?
1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol has a molecular weight of 335.45 g/mol, XLogP of 1.27, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-amino-6-propan-2-yloxypyrimidin-4-yl)piperidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 72839277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).