6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide

C13H13ClN4O2 — CID 28823587

IUPAC6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCN1C[C@H](NC(=O)c2cn3cc(Cl)ccc3n2)CC1=O
InChIInChI=1S/C13H13ClN4O2/c1-17-6-9(4-12(17)19)15-13(20)10-7-18-5-8(14)2-3-11(18)16-10/h2-3,5,7,9H,4,6H2,1H3,(H,15,20)/t9-/m1/s1
InChIKeyKVSGYWVUQAPZQN-SECBINFHSA-N
MW292.73 g/mol
LogP0.95
Rot. Bonds2

About 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide

6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 28823587) has the molecular formula C13H13ClN4O2 and a molecular weight of 292.73 g/mol. Its IUPAC name is 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID28823587
Molecular FormulaC13H13ClN4O2
Molecular Weight292.73 g/mol
Exact Mass292.07
IUPAC Name6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCN1C[C@H](NC(=O)c2cn3cc(Cl)ccc3n2)CC1=O
InChIInChI=1S/C13H13ClN4O2/c1-17-6-9(4-12(17)19)15-13(20)10-7-18-5-8(14)2-3-11(18)16-10/h2-3,5,7,9H,4,6H2,1H3,(H,15,20)/t9-/m1/s1
InChIKeyKVSGYWVUQAPZQN-SECBINFHSA-N
XLogP0.95
TPSA66.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.73
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide (CID 28823587) is 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide is CN1C[C@H](NC(=O)c2cn3cc(Cl)ccc3n2)CC1=O.
What is the InChIKey of 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is KVSGYWVUQAPZQN-SECBINFHSA-N. The full InChI is InChI=1S/C13H13ClN4O2/c1-17-6-9(4-12(17)19)15-13(20)10-7-18-5-8(14)2-3-11(18)16-10/h2-3,5,7,9H,4,6H2,1H3,(H,15,20)/t9-/m1/s1.
What are the key properties of 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide?
6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 292.73 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[(3R)-1-methyl-5-oxopyrrolidin-3-yl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 28823587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).