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

C18H20N4O — CID 129331749

IUPACN-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide
SMILESCN(C[C@@H]1CCc2nccn2C1)C(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C18H20N4O/c1-21(11-13-5-6-16-19-9-10-22(16)12-13)18(23)15-4-2-3-14-7-8-20-17(14)15/h2-4,7-10,13,20H,5-6,11-12H2,1H3/t13-/m0/s1
InChIKeyJYHZCFIKQVYGST-ZDUSSCGKSA-N
MW308.38 g/mol
LogP2.70
Rot. Bonds3

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

N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide (PubChem CID 129331749) has the molecular formula C18H20N4O and a molecular weight of 308.38 g/mol. Its IUPAC name is N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide
PubChem CID129331749
Molecular FormulaC18H20N4O
Molecular Weight308.38 g/mol
Exact Mass308.16
IUPAC NameN-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide
SMILESCN(C[C@@H]1CCc2nccn2C1)C(=O)c1cccc2cc[nH]c12
InChIInChI=1S/C18H20N4O/c1-21(11-13-5-6-16-19-9-10-22(16)12-13)18(23)15-4-2-3-14-7-8-20-17(14)15/h2-4,7-10,13,20H,5-6,11-12H2,1H3/t13-/m0/s1
InChIKeyJYHZCFIKQVYGST-ZDUSSCGKSA-N
XLogP2.70
TPSA53.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide?
The IUPAC name of N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide (CID 129331749) is N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide.
What is the SMILES notation for N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide?
The canonical SMILES for N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide is CN(C[C@@H]1CCc2nccn2C1)C(=O)c1cccc2cc[nH]c12.
What is the InChIKey of N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide?
The InChIKey is JYHZCFIKQVYGST-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H20N4O/c1-21(11-13-5-6-16-19-9-10-22(16)12-13)18(23)15-4-2-3-14-7-8-20-17(14)15/h2-4,7-10,13,20H,5-6,11-12H2,1H3/t13-/m0/s1.
What are the key properties of N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide?
N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide has a molecular weight of 308.38 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]methyl]-1H-indole-7-carboxamide is sourced from PubChem (CID 129331749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).