6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide

C18H19ClN4O — CID 100630533

About 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide

6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide (PubChem CID 100630533) has the molecular formula C18H19ClN4O and a molecular weight of 342.83 g/mol. Its IUPAC name is 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide.

Molecular Properties

• Compound Name: 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide
• PubChem CID: 100630533
• Molecular Formula: C18H19ClN4O
• Molecular Weight: 342.83 g/mol
• Exact Mass: 342.12
• IUPAC Name: 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide
• SMILES: CN(C[C@@H]1CCn2ccnc2C1)C(=O)c1cc2ccc(Cl)cc2[nH]1
• InChI: InChI=1S/C18H19ClN4O/c1-22(11-12-4-6-23-7-5-20-17(23)8-12)18(24)16-9-13-2-3-14(19)10-15(13)21-16/h2-3,5,7,9-10,12,21H,4,6,8,11H2,1H3/t12-/m1/s1
• InChIKey: HJSQXJAHBJARDH-GFCCVEGCSA-N
• XLogP: 3.35
• TPSA: 53.92 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 3
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	342.83
LogP ≤ 5	3.35
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide?

The IUPAC name of 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide (CID 100630533) is 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide.

What is the SMILES notation for 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide?

The canonical SMILES for 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide is CN(C[C@@H]1CCn2ccnc2C1)C(=O)c1cc2ccc(Cl)cc2[nH]1.

What is the InChIKey of 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide?

The InChIKey is HJSQXJAHBJARDH-GFCCVEGCSA-N. The full InChI is InChI=1S/C18H19ClN4O/c1-22(11-12-4-6-23-7-5-20-17(23)8-12)18(24)16-9-13-2-3-14(19)10-15(13)21-16/h2-3,5,7,9-10,12,21H,4,6,8,11H2,1H3/t12-/m1/s1.

What are the key properties of 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide?

6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide has a molecular weight of 342.83 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-N-methyl-N-[[(7R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-7-yl]methyl]-1H-indole-2-carboxamide is sourced from PubChem (CID 100630533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).