4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide

C20H26N4O — CID 16673218

IUPAC4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide
SMILESCCn1c(C)cc2cc(NC(=O)CCCn3nc(C)cc3C)ccc21
InChIInChI=1S/C20H26N4O/c1-5-23-15(3)12-17-13-18(8-9-19(17)23)21-20(25)7-6-10-24-16(4)11-14(2)22-24/h8-9,11-13H,5-7,10H2,1-4H3,(H,21,25)
InChIKeyQXNHLLNPKCDTGC-UHFFFAOYSA-N
MW338.46 g/mol
LogP4.20
Rot. Bonds6

About 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide

4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide (PubChem CID 16673218) has the molecular formula C20H26N4O and a molecular weight of 338.46 g/mol. Its IUPAC name is 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide.

Molecular Properties

Compound Name4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide
PubChem CID16673218
Molecular FormulaC20H26N4O
Molecular Weight338.46 g/mol
Exact Mass338.21
IUPAC Name4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide
SMILESCCn1c(C)cc2cc(NC(=O)CCCn3nc(C)cc3C)ccc21
InChIInChI=1S/C20H26N4O/c1-5-23-15(3)12-17-13-18(8-9-19(17)23)21-20(25)7-6-10-24-16(4)11-14(2)22-24/h8-9,11-13H,5-7,10H2,1-4H3,(H,21,25)
InChIKeyQXNHLLNPKCDTGC-UHFFFAOYSA-N
XLogP4.20
TPSA51.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.46
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,5-dimethylpyrazol-1-yl)-N-phenylbutanamide
CID 39730494
N-[2-[2-(3,5-dimethylpyrazol-1-yl)ethyl]-1-methylbenzimidazol-5-yl]butanamide
CID 17218644
N-[3-(aminomethyl)phenyl]-4-(3,5-dimethylpyrazol-1-yl)butanamide
CID 16782185
2-amino-N-(1-ethyl-2-methylindol-5-yl)propanamide
CID 131907510
N-[4-(diethylamino)phenyl]-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 19553830
N-(1-ethyl-2-methylindol-5-yl)-3-(1-methylpiperidin-2-yl)propanamide
CID 131946875
N-[2-(3,5-dimethylpyrazol-1-yl)ethyl]pentanamide
CID 71782926
N-(2-amino-4-fluorophenyl)-4-(3,5-dimethylpyrazol-1-yl)butanamide
CID 16786978
N-(1-ethyl-2-methylindol-5-yl)-2-(6-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl)acetamide
CID 46963557
3-(3,5-dimethylpyrazol-1-yl)-N-pyridin-3-ylpropanamide
CID 15943466
N-(1-ethyl-2-methylindol-5-yl)-2-propan-2-yl-1,3-thiazole-4-carboxamide
CID 131945031
N-(2,6-dimethylphenyl)-3-(3,5-dimethylpyrazol-1-yl)propanamide
CID 19553862

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide?
The IUPAC name of 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide (CID 16673218) is 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide.
What is the SMILES notation for 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide?
The canonical SMILES for 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide is CCn1c(C)cc2cc(NC(=O)CCCn3nc(C)cc3C)ccc21.
What is the InChIKey of 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide?
The InChIKey is QXNHLLNPKCDTGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N4O/c1-5-23-15(3)12-17-13-18(8-9-19(17)23)21-20(25)7-6-10-24-16(4)11-14(2)22-24/h8-9,11-13H,5-7,10H2,1-4H3,(H,21,25).
What are the key properties of 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide?
4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide has a molecular weight of 338.46 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpyrazol-1-yl)-N-(1-ethyl-2-methylindol-5-yl)butanamide is sourced from PubChem (CID 16673218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).