N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide

C18H19N5O2 — CID 86772662

IUPACN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide
SMILESCc1cn2c(n1)CCC(NC(=O)Cn1ncc3ccccc3c1=O)C2
InChIInChI=1S/C18H19N5O2/c1-12-9-22-10-14(6-7-16(22)20-12)21-17(24)11-23-18(25)15-5-3-2-4-13(15)8-19-23/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,21,24)
InChIKeyTVDXYGGNGAPCOW-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.03
Rot. Bonds3

About N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide

N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide (PubChem CID 86772662) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide
PubChem CID86772662
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC NameN-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide
SMILESCc1cn2c(n1)CCC(NC(=O)Cn1ncc3ccccc3c1=O)C2
InChIInChI=1S/C18H19N5O2/c1-12-9-22-10-14(6-7-16(22)20-12)21-17(24)11-23-18(25)15-5-3-2-4-13(15)8-19-23/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,21,24)
InChIKeyTVDXYGGNGAPCOW-UHFFFAOYSA-N
XLogP1.03
TPSA81.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(1-methylindol-3-yl)-N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
CID 86772729
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 86772539
N-(1-benzylpiperidin-4-yl)-2-(1-oxophthalazin-2-yl)acetamide
CID 35558093
2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95766083
2-(4-methyl-1-oxophthalazin-2-yl)-N-[(6R)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95138432
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-thiophen-2-ylacetamide
CID 86772548
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide
CID 86772537
2-(3-methylphenyl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 95788774
2-(2,4-dioxo-1,3-diazinan-1-yl)-N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]acetamide
CID 96502955
N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-phenylmethoxyacetamide
CID 95765808
N-[(6R)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-2-(2-oxo-1,3-diazinan-1-yl)acetamide
CID 95766034
N-[(6S)-2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl]-3-(5-phenyl-1H-pyrrol-2-yl)propanamide
CID 95138623

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide?
The IUPAC name of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide (CID 86772662) is N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide.
What is the SMILES notation for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide?
The canonical SMILES for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide is Cc1cn2c(n1)CCC(NC(=O)Cn1ncc3ccccc3c1=O)C2.
What is the InChIKey of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide?
The InChIKey is TVDXYGGNGAPCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-12-9-22-10-14(6-7-16(22)20-12)21-17(24)11-23-18(25)15-5-3-2-4-13(15)8-19-23/h2-5,8-9,14H,6-7,10-11H2,1H3,(H,21,24).
What are the key properties of N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide?
N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide has a molecular weight of 337.38 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-2-(1-oxophthalazin-2-yl)acetamide is sourced from PubChem (CID 86772662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).