6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione

C18H15N5O3 — CID 155549423

IUPAC6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione
SMILESCc1c(-c2ccc(Nc3nccc4occc34)nc2)n(C)c(=O)[nH]c1=O
InChIInChI=1S/C18H15N5O3/c1-10-15(23(2)18(25)22-17(10)24)11-3-4-14(20-9-11)21-16-12-6-8-26-13(12)5-7-19-16/h3-9H,1-2H3,(H,19,20,21)(H,22,24,25)
InChIKeyLOUGEFVASUWEKZ-UHFFFAOYSA-N
MW349.35 g/mol
LogP2.33
Rot. Bonds3

About 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione

6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione (PubChem CID 155549423) has the molecular formula C18H15N5O3 and a molecular weight of 349.35 g/mol. Its IUPAC name is 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione
PubChem CID155549423
Molecular FormulaC18H15N5O3
Molecular Weight349.35 g/mol
Exact Mass349.12
IUPAC Name6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione
SMILESCc1c(-c2ccc(Nc3nccc4occc34)nc2)n(C)c(=O)[nH]c1=O
InChIInChI=1S/C18H15N5O3/c1-10-15(23(2)18(25)22-17(10)24)11-3-4-14(20-9-11)21-16-12-6-8-26-13(12)5-7-19-16/h3-9H,1-2H3,(H,19,20,21)(H,22,24,25)
InChIKeyLOUGEFVASUWEKZ-UHFFFAOYSA-N
XLogP2.33
TPSA105.81 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione?
The IUPAC name of 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione (CID 155549423) is 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione is Cc1c(-c2ccc(Nc3nccc4occc34)nc2)n(C)c(=O)[nH]c1=O.
What is the InChIKey of 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione?
The InChIKey is LOUGEFVASUWEKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O3/c1-10-15(23(2)18(25)22-17(10)24)11-3-4-14(20-9-11)21-16-12-6-8-26-13(12)5-7-19-16/h3-9H,1-2H3,(H,19,20,21)(H,22,24,25).
What are the key properties of 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione?
6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione has a molecular weight of 349.35 g/mol, XLogP of 2.33, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(furo[3,2-c]pyridin-4-ylamino)-3-pyridinyl]-1,5-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 155549423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).