1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide

C11H15BrN4O — CID 122236400

IUPAC1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide
SMILESBr.O=c1[nH]c2cnccc2n1C1CCNCC1
InChIInChI=1S/C11H14N4O.BrH/c16-11-14-9-7-13-6-3-10(9)15(11)8-1-4-12-5-2-8;/h3,6-8,12H,1-2,4-5H2,(H,14,16);1H
InChIKeyJZHHPNNUNXXRPX-UHFFFAOYSA-N
MW299.17 g/mol
LogP1.23
Rot. Bonds1

About 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide

1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide (PubChem CID 122236400) has the molecular formula C11H15BrN4O and a molecular weight of 299.17 g/mol. Its IUPAC name is 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide.

Molecular Properties

Compound Name1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide
PubChem CID122236400
Molecular FormulaC11H15BrN4O
Molecular Weight299.17 g/mol
Exact Mass298.04
IUPAC Name1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide
SMILESBr.O=c1[nH]c2cnccc2n1C1CCNCC1
InChIInChI=1S/C11H14N4O.BrH/c16-11-14-9-7-13-6-3-10(9)15(11)8-1-4-12-5-2-8;/h3,6-8,12H,1-2,4-5H2,(H,14,16);1H
InChIKeyJZHHPNNUNXXRPX-UHFFFAOYSA-N
XLogP1.23
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide?
The IUPAC name of 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide (CID 122236400) is 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide.
What is the SMILES notation for 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide?
The canonical SMILES for 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide is Br.O=c1[nH]c2cnccc2n1C1CCNCC1.
What is the InChIKey of 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide?
The InChIKey is JZHHPNNUNXXRPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O.BrH/c16-11-14-9-7-13-6-3-10(9)15(11)8-1-4-12-5-2-8;/h3,6-8,12H,1-2,4-5H2,(H,14,16);1H.
What are the key properties of 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide?
1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide has a molecular weight of 299.17 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-4-yl-3H-imidazo[4,5-c]pyridin-2-one;hydrobromide is sourced from PubChem (CID 122236400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).