3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide

C20H20N8O — CID 10249673

IUPAC3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide
SMILESCc1cccc(-c2nc3cc(C(=O)NN(C)C)ccn3c2-c2ccnc(N)n2)n1
InChIInChI=1S/C20H20N8O/c1-12-5-4-6-14(23-12)17-18(15-7-9-22-20(21)24-15)28-10-8-13(11-16(28)25-17)19(29)26-27(2)3/h4-11H,1-3H3,(H,26,29)(H2,21,22,24)
InChIKeyVKODDBPPNQPIEV-UHFFFAOYSA-N
MW388.44 g/mol
LogP1.95
Rot. Bonds4

About 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide

3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide (PubChem CID 10249673) has the molecular formula C20H20N8O and a molecular weight of 388.44 g/mol. Its IUPAC name is 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide.

Molecular Properties

Compound Name3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide
PubChem CID10249673
Molecular FormulaC20H20N8O
Molecular Weight388.44 g/mol
Exact Mass388.18
IUPAC Name3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide
SMILESCc1cccc(-c2nc3cc(C(=O)NN(C)C)ccn3c2-c2ccnc(N)n2)n1
InChIInChI=1S/C20H20N8O/c1-12-5-4-6-14(23-12)17-18(15-7-9-22-20(21)24-15)28-10-8-13(11-16(28)25-17)19(29)26-27(2)3/h4-11H,1-3H3,(H,26,29)(H2,21,22,24)
InChIKeyVKODDBPPNQPIEV-UHFFFAOYSA-N
XLogP1.95
TPSA114.33 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.44
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(2-aminopyrimidin-4-yl)-N-(2-hydroxyethyl)-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carboxamide
CID 66678363
3-(2-aminopyrimidin-4-yl)-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-6-carboxylic acid
CID 66678798
3-(2-aminopyrimidin-4-yl)-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-6-carboxylic acid;hydroxylamine
CID 69378660
4-[6-chloro-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
CID 66679435
3-(2-aminopyrimidin-4-yl)-N-(2-methoxyethyl)-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-6-carboxamide
CID 66679141
4-[[4-[2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]amino]butanamide
CID 69327635
3-(2-aminopyrimidin-4-yl)-6-methyl-2-(6-methyl-2-pyridinyl)-N-(2-pyridin-2-ylethyl)imidazo[1,2-a]pyridin-8-amine
CID 66679083
N-[3-(2-aminopyrimidin-4-yl)-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyrimidin-7-yl]-2-(3-methoxyphenyl)acetamide;2-(3-methoxyphenyl)acetyl chloride
CID 157339070
3-(2-aminopyrimidin-4-yl)-2-[3-[(2,6-difluorophenyl)sulfonylamino]-2-fluorophenyl]imidazo[1,2-a]pyridine-7-carboxylic acid
CID 154957923
4-[2-(3-methylphenyl)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-amine
CID 58278215
methyl 2-(6-methyl-2-pyridinyl)-3-(2-methylsulfanylpyrimidin-4-yl)imidazo[1,2-a]pyridine-6-carboxylate
CID 66679037
N-[3-(2-aminopyrimidin-4-yl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-7-yl]-N',N'-dimethylethane-1,2-diamine
CID 155526334

Frequently Asked Questions

What is the IUPAC name of 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide?
The IUPAC name of 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide (CID 10249673) is 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide.
What is the SMILES notation for 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide?
The canonical SMILES for 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide is Cc1cccc(-c2nc3cc(C(=O)NN(C)C)ccn3c2-c2ccnc(N)n2)n1.
What is the InChIKey of 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide?
The InChIKey is VKODDBPPNQPIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N8O/c1-12-5-4-6-14(23-12)17-18(15-7-9-22-20(21)24-15)28-10-8-13(11-16(28)25-17)19(29)26-27(2)3/h4-11H,1-3H3,(H,26,29)(H2,21,22,24).
What are the key properties of 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide?
3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide has a molecular weight of 388.44 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-aminopyrimidin-4-yl)-N',N'-dimethyl-2-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-7-carbohydrazide is sourced from PubChem (CID 10249673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).