N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide

C17H22N4O — CID 71929221

IUPACN-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide
SMILESCNC(=O)c1ccc(CNCC2CCCn3ccnc32)cc1
InChIInChI=1S/C17H22N4O/c1-18-17(22)14-6-4-13(5-7-14)11-19-12-15-3-2-9-21-10-8-20-16(15)21/h4-8,10,15,19H,2-3,9,11-12H2,1H3,(H,18,22)
InChIKeyAWQPKFIDAUCHCW-UHFFFAOYSA-N
MW298.39 g/mol
LogP1.91
Rot. Bonds5

About N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide

N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide (PubChem CID 71929221) has the molecular formula C17H22N4O and a molecular weight of 298.39 g/mol. Its IUPAC name is N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide.

Molecular Properties

Compound NameN-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide
PubChem CID71929221
Molecular FormulaC17H22N4O
Molecular Weight298.39 g/mol
Exact Mass298.18
IUPAC NameN-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide
SMILESCNC(=O)c1ccc(CNCC2CCCn3ccnc32)cc1
InChIInChI=1S/C17H22N4O/c1-18-17(22)14-6-4-13(5-7-14)11-19-12-15-3-2-9-21-10-8-20-16(15)21/h4-8,10,15,19H,2-3,9,11-12H2,1H3,(H,18,22)
InChIKeyAWQPKFIDAUCHCW-UHFFFAOYSA-N
XLogP1.91
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide?
The IUPAC name of N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide (CID 71929221) is N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide.
What is the SMILES notation for N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide?
The canonical SMILES for N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide is CNC(=O)c1ccc(CNCC2CCCn3ccnc32)cc1.
What is the InChIKey of N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide?
The InChIKey is AWQPKFIDAUCHCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O/c1-18-17(22)14-6-4-13(5-7-14)11-19-12-15-3-2-9-21-10-8-20-16(15)21/h4-8,10,15,19H,2-3,9,11-12H2,1H3,(H,18,22).
What are the key properties of N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide?
N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide has a molecular weight of 298.39 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-ylmethylamino)methyl]benzamide is sourced from PubChem (CID 71929221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).