3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide

C12H16N4O — CID 110481555

IUPAC3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide
SMILESCN(C)CCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C12H16N4O/c1-16(2)7-6-12(17)14-10-4-3-5-11-9(10)8-13-15-11/h3-5,8H,6-7H2,1-2H3,(H,13,15)(H,14,17)
InChIKeyIUZUIJIULCLRDM-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.45
Rot. Bonds4

About 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide

3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide (PubChem CID 110481555) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide
PubChem CID110481555
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC Name3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide
SMILESCN(C)CCC(=O)Nc1cccc2[nH]ncc12
InChIInChI=1S/C12H16N4O/c1-16(2)7-6-12(17)14-10-4-3-5-11-9(10)8-13-15-11/h3-5,8H,6-7H2,1-2H3,(H,13,15)(H,14,17)
InChIKeyIUZUIJIULCLRDM-UHFFFAOYSA-N
XLogP1.45
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide?
The IUPAC name of 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide (CID 110481555) is 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide.
What is the SMILES notation for 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide?
The canonical SMILES for 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide is CN(C)CCC(=O)Nc1cccc2[nH]ncc12.
What is the InChIKey of 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide?
The InChIKey is IUZUIJIULCLRDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-16(2)7-6-12(17)14-10-4-3-5-11-9(10)8-13-15-11/h3-5,8H,6-7H2,1-2H3,(H,13,15)(H,14,17).
What are the key properties of 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide?
3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide has a molecular weight of 232.29 g/mol, XLogP of 1.45, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide is sourced from PubChem (CID 110481555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).