2-ethyl-N-propylindazole-6-carboxamide

C13H17N3O — CID 160670510

IUPAC2-ethyl-N-propylindazole-6-carboxamide
SMILESCCCNC(=O)c1ccc2cn(CC)nc2c1
InChIInChI=1S/C13H17N3O/c1-3-7-14-13(17)10-5-6-11-9-16(4-2)15-12(11)8-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,14,17)
InChIKeyJNUCVUWYZCZWAQ-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.20
Rot. Bonds4

About 2-ethyl-N-propylindazole-6-carboxamide

2-ethyl-N-propylindazole-6-carboxamide (PubChem CID 160670510) has the molecular formula C13H17N3O and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-ethyl-N-propylindazole-6-carboxamide.

Molecular Properties

Compound Name2-ethyl-N-propylindazole-6-carboxamide
PubChem CID160670510
Molecular FormulaC13H17N3O
Molecular Weight231.30 g/mol
Exact Mass231.14
IUPAC Name2-ethyl-N-propylindazole-6-carboxamide
SMILESCCCNC(=O)c1ccc2cn(CC)nc2c1
InChIInChI=1S/C13H17N3O/c1-3-7-14-13(17)10-5-6-11-9-16(4-2)15-12(11)8-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,14,17)
InChIKeyJNUCVUWYZCZWAQ-UHFFFAOYSA-N
XLogP2.20
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-ethylindazol-6-yl)-piperidin-1-ylmethanone
CID 53017469
N-propylnaphthalene-2-carboxamide
CID 6624536
6-(propylcarbamoyl)naphthalene-2-carboxylic acid
CID 139642234
N-[2-(dimethylamino)ethyl]-2-(3,3-diphenylpropyl)indazole-6-carboxamide
CID 24953915
2-methyl-N-propyl-3H-benzimidazole-5-carboxamide
CID 594617
2,3-diphenyl-N-propylquinoxaline-6-carboxamide
CID 3107662
2-ethylindazole-5-carboxamide
CID 142796121
ethane;2-ethyl-6-methylindazole
CID 177232653
1-(3,5-dimethylphenyl)-N-propylbenzimidazole-5-carboxamide
CID 3662061
N-hydroxy-2-(2-phenylethyl)indazole-6-carboxamide
CID 169188075
4-fluoro-3-hydroxy-N-propylbenzamide
CID 130057564
N-propyl-2-[4-(propylcarbamoyl)-2-pyridinyl]pyridine-4-carboxamide
CID 57050532

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-propylindazole-6-carboxamide?
The IUPAC name of 2-ethyl-N-propylindazole-6-carboxamide (CID 160670510) is 2-ethyl-N-propylindazole-6-carboxamide.
What is the SMILES notation for 2-ethyl-N-propylindazole-6-carboxamide?
The canonical SMILES for 2-ethyl-N-propylindazole-6-carboxamide is CCCNC(=O)c1ccc2cn(CC)nc2c1.
What is the InChIKey of 2-ethyl-N-propylindazole-6-carboxamide?
The InChIKey is JNUCVUWYZCZWAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O/c1-3-7-14-13(17)10-5-6-11-9-16(4-2)15-12(11)8-10/h5-6,8-9H,3-4,7H2,1-2H3,(H,14,17).
What are the key properties of 2-ethyl-N-propylindazole-6-carboxamide?
2-ethyl-N-propylindazole-6-carboxamide has a molecular weight of 231.30 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-propylindazole-6-carboxamide is sourced from PubChem (CID 160670510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).