3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide

C15H17N5O2 — CID 84577900

IUPAC3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide
SMILESCc1[nH]c(=O)n(CCC(=O)Nc2ccc3cn[nH]c3c2)c1C
InChIInChI=1S/C15H17N5O2/c1-9-10(2)20(15(22)17-9)6-5-14(21)18-12-4-3-11-8-16-19-13(11)7-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,19)(H,17,22)(H,18,21)
InChIKeyKHWIJDQXMUAPDZ-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.70
Rot. Bonds4

About 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide

3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide (PubChem CID 84577900) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide.

Molecular Properties

Compound Name3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide
PubChem CID84577900
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Name3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide
SMILESCc1[nH]c(=O)n(CCC(=O)Nc2ccc3cn[nH]c3c2)c1C
InChIInChI=1S/C15H17N5O2/c1-9-10(2)20(15(22)17-9)6-5-14(21)18-12-4-3-11-8-16-19-13(11)7-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,19)(H,17,22)(H,18,21)
InChIKeyKHWIJDQXMUAPDZ-UHFFFAOYSA-N
XLogP1.70
TPSA95.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-acetylphenyl)-3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)propanamide
CID 84577861
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(5-methyl-1H-pyrazol-3-yl)propanamide
CID 112524744
N-(1H-indazol-6-yl)-3-(4-methylphenyl)propanamide
CID 36563064
5-amino-N-(1H-indazol-6-yl)-4-methylpentanamide
CID 82012714
N-(1H-indazol-6-yl)-3-(2-methylphenyl)propanamide
CID 110731205
N-(1H-indazol-6-yl)-2-(5-methyl-1,2,4-oxadiazol-3-yl)acetamide
CID 110675279
N-(1H-indazol-6-yl)-2-(1-methyl-3,5-dioxopyrazolidin-4-yl)acetamide
CID 110703585
2-(1,2-dimethylbenzimidazol-5-yl)-N-(1H-indazol-6-yl)acetamide
CID 110773214
3-(4-fluorophenyl)-N-(1H-indazol-6-yl)propanamide
CID 36561610
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-pyridin-2-ylpropanamide
CID 84577763
2-amino-N-[2-(1H-indazol-6-ylamino)-2-oxoethyl]acetamide
CID 60849787
N-(1H-indazol-6-yl)-2-(2-oxo-1,3-dihydrobenzimidazol-5-yl)acetamide
CID 110772201

Frequently Asked Questions

What is the IUPAC name of 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide?
The IUPAC name of 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide (CID 84577900) is 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide.
What is the SMILES notation for 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide?
The canonical SMILES for 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide is Cc1[nH]c(=O)n(CCC(=O)Nc2ccc3cn[nH]c3c2)c1C.
What is the InChIKey of 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide?
The InChIKey is KHWIJDQXMUAPDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-9-10(2)20(15(22)17-9)6-5-14(21)18-12-4-3-11-8-16-19-13(11)7-12/h3-4,7-8H,5-6H2,1-2H3,(H,16,19)(H,17,22)(H,18,21).
What are the key properties of 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide?
3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide has a molecular weight of 299.33 g/mol, XLogP of 1.70, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,5-dimethyl-2-oxo-1H-imidazol-3-yl)-N-(1H-indazol-6-yl)propanamide is sourced from PubChem (CID 84577900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).