1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine

C18H30N4O2 — CID 162637175

IUPAC1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine
SMILESCOC1(CN(C)C)CCN(CC2Cc3c(C)nc(C)nc3O2)CC1
InChIInChI=1S/C18H30N4O2/c1-13-16-10-15(24-17(16)20-14(2)19-13)11-22-8-6-18(23-5,7-9-22)12-21(3)4/h15H,6-12H2,1-5H3
InChIKeyUHBNILRNPZNGMI-UHFFFAOYSA-N
MW334.46 g/mol
LogP1.44
Rot. Bonds5

About 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine

1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine (PubChem CID 162637175) has the molecular formula C18H30N4O2 and a molecular weight of 334.46 g/mol. Its IUPAC name is 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine
PubChem CID162637175
Molecular FormulaC18H30N4O2
Molecular Weight334.46 g/mol
Exact Mass334.24
IUPAC Name1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine
SMILESCOC1(CN(C)C)CCN(CC2Cc3c(C)nc(C)nc3O2)CC1
InChIInChI=1S/C18H30N4O2/c1-13-16-10-15(24-17(16)20-14(2)19-13)11-22-8-6-18(23-5,7-9-22)12-21(3)4/h15H,6-12H2,1-5H3
InChIKeyUHBNILRNPZNGMI-UHFFFAOYSA-N
XLogP1.44
TPSA50.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine (CID 162637175) is 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine is COC1(CN(C)C)CCN(CC2Cc3c(C)nc(C)nc3O2)CC1.
What is the InChIKey of 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine?
The InChIKey is UHBNILRNPZNGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N4O2/c1-13-16-10-15(24-17(16)20-14(2)19-13)11-22-8-6-18(23-5,7-9-22)12-21(3)4/h15H,6-12H2,1-5H3.
What are the key properties of 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine?
1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine has a molecular weight of 334.46 g/mol, XLogP of 1.44, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[(2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidin-6-yl)methyl]-4-methoxypiperidin-4-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 162637175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).