2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine

C18H19N3O — CID 10613667

IUPAC2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine
SMILESCc1nc(N2CCCCC2)c2oc(-c3ccccc3)cc2n1
InChIInChI=1S/C18H19N3O/c1-13-19-15-12-16(14-8-4-2-5-9-14)22-17(15)18(20-13)21-10-6-3-7-11-21/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
InChIKeyAMMCABHUSVJTAC-UHFFFAOYSA-N
MW293.37 g/mol
LogP4.19
Rot. Bonds2

About 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine

2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine (PubChem CID 10613667) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine.

Molecular Properties

Compound Name2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine
PubChem CID10613667
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC Name2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine
SMILESCc1nc(N2CCCCC2)c2oc(-c3ccccc3)cc2n1
InChIInChI=1S/C18H19N3O/c1-13-19-15-12-16(14-8-4-2-5-9-14)22-17(15)18(20-13)21-10-6-3-7-11-21/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3
InChIKeyAMMCABHUSVJTAC-UHFFFAOYSA-N
XLogP4.19
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 54.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 57399746
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CID 1399676
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CID 603361
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CID 621402
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CID 656347
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CID 2306318
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CID 134611710
CID 134611710

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine?
The IUPAC name of 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine (CID 10613667) is 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine.
What is the SMILES notation for 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine?
The canonical SMILES for 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine is Cc1nc(N2CCCCC2)c2oc(-c3ccccc3)cc2n1.
What is the InChIKey of 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine?
The InChIKey is AMMCABHUSVJTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c1-13-19-15-12-16(14-8-4-2-5-9-14)22-17(15)18(20-13)21-10-6-3-7-11-21/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3.
What are the key properties of 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine?
2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine has a molecular weight of 293.37 g/mol, XLogP of 4.19, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-phenyl-4-piperidin-1-ylfuro[3,2-d]pyrimidine is sourced from PubChem (CID 10613667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).