6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one

C14H20N4O — CID 147290637

IUPAC6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one
SMILESCC(C)c1nc2c(c(=O)[nH]1)CC(N1CCCCC1)=N2
InChIInChI=1S/C14H20N4O/c1-9(2)12-16-13-10(14(19)17-12)8-11(15-13)18-6-4-3-5-7-18/h9H,3-8H2,1-2H3,(H,16,17,19)
InChIKeyCUCUMRPFCMZCQN-UHFFFAOYSA-N
MW260.34 g/mol
LogP1.97
Rot. Bonds1

About 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one

6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one (PubChem CID 147290637) has the molecular formula C14H20N4O and a molecular weight of 260.34 g/mol. Its IUPAC name is 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one
PubChem CID147290637
Molecular FormulaC14H20N4O
Molecular Weight260.34 g/mol
Exact Mass260.16
IUPAC Name6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one
SMILESCC(C)c1nc2c(c(=O)[nH]1)CC(N1CCCCC1)=N2
InChIInChI=1S/C14H20N4O/c1-9(2)12-16-13-10(14(19)17-12)8-11(15-13)18-6-4-3-5-7-18/h9H,3-8H2,1-2H3,(H,16,17,19)
InChIKeyCUCUMRPFCMZCQN-UHFFFAOYSA-N
XLogP1.97
TPSA61.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one with MolForge

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Related Compounds

5-(2-oxo-2-piperidin-1-ylethyl)-2-propan-2-yl-1H-pyrimidin-6-one
CID 90925807
2-Chloro-3-[2-(methylamino)ethyl]-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 83899204
3-(1-Aminopropan-2-yl)-2-chloro-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CID 83899206
4-amino-2-(piperazin-1-ylmethyl)-5-propyl-1H-pyrimidin-6-one
CID 136077463
4-amino-2-(piperazin-1-ylmethyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 136077464
4-amino-5-ethyl-2-piperidin-2-yl-1H-pyrimidin-6-one
CID 136077567
4-amino-2-(1-piperazin-1-ylethyl)-5-propyl-1H-pyrimidin-6-one
CID 136077577
4-amino-2-(1-piperazin-1-ylethyl)-5-propan-2-yl-1H-pyrimidin-6-one
CID 136077578
4-amino-5-ethyl-2-(1-piperazin-1-ylpropyl)-1H-pyrimidin-6-one
CID 136077647
4-amino-2-[2-(diethylamino)ethyl]-5-ethyl-1H-pyrimidin-6-one
CID 136077654
4-amino-5-ethyl-2-piperidin-3-yl-1H-pyrimidin-6-one
CID 136077677
4-amino-2-(1-piperazin-1-ylpropyl)-5-propyl-1H-pyrimidin-6-one
CID 136077686

Frequently Asked Questions

What is the IUPAC name of 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The IUPAC name of 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one (CID 147290637) is 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The canonical SMILES for 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one is CC(C)c1nc2c(c(=O)[nH]1)CC(N1CCCCC1)=N2.
What is the InChIKey of 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The InChIKey is CUCUMRPFCMZCQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O/c1-9(2)12-16-13-10(14(19)17-12)8-11(15-13)18-6-4-3-5-7-18/h9H,3-8H2,1-2H3,(H,16,17,19).
What are the key properties of 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one?
6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one has a molecular weight of 260.34 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-piperidin-1-yl-2-propan-2-yl-3,5-dihydropyrrolo[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 147290637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).