N-butyl-N-ethyl-1H-indazole-6-carboxamide

C14H19N3O — CID 55023829

IUPACN-butyl-N-ethyl-1H-indazole-6-carboxamide
SMILESCCCCN(CC)C(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H19N3O/c1-3-5-8-17(4-2)14(18)11-6-7-12-10-15-16-13(12)9-11/h6-7,9-10H,3-5,8H2,1-2H3,(H,15,16)
InChIKeyHAAYUOWPGMGEFP-UHFFFAOYSA-N
MW245.33 g/mol
LogP2.83
Rot. Bonds5

About N-butyl-N-ethyl-1H-indazole-6-carboxamide

N-butyl-N-ethyl-1H-indazole-6-carboxamide (PubChem CID 55023829) has the molecular formula C14H19N3O and a molecular weight of 245.33 g/mol. Its IUPAC name is N-butyl-N-ethyl-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN-butyl-N-ethyl-1H-indazole-6-carboxamide
PubChem CID55023829
Molecular FormulaC14H19N3O
Molecular Weight245.33 g/mol
Exact Mass245.15
IUPAC NameN-butyl-N-ethyl-1H-indazole-6-carboxamide
SMILESCCCCN(CC)C(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C14H19N3O/c1-3-5-8-17(4-2)14(18)11-6-7-12-10-15-16-13(12)9-11/h6-7,9-10H,3-5,8H2,1-2H3,(H,15,16)
InChIKeyHAAYUOWPGMGEFP-UHFFFAOYSA-N
XLogP2.83
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide
CID 62923706
N-(2-hydroxyethyl)-N-methyl-1H-indazole-6-carboxamide
CID 60960458
N-cyclopentyl-N-ethyl-1H-indazole-6-carboxamide
CID 62905257
N-methyl-N-(2-methylbutan-2-yl)-1H-indazole-6-carboxamide
CID 63960134
N',N'-dibutyl-N-(1H-indazol-6-yl)oxamide
CID 108524558
N,N-dibutylnaphthalene-2-carboxamide
CID 154151885
N-ethyl-N-(3-fluorophenyl)-1H-indazole-6-carboxamide
CID 62905806
N-(2-cyanoethyl)-N-(2-methoxyethyl)-1H-indazole-6-carboxamide
CID 63286734
N-butyl-N-ethyl-2,3-dihydro-1H-indole-5-carboxamide
CID 43142468
N-butyl-N-ethyl-2,3-dimethyl-1H-indole-5-carboxamide
CID 18164314
3-N-(1H-indazol-6-yl)-3-N-propylbenzene-1,3-dicarboxamide
CID 177246462
N-butyl-2,6-dichloro-N-ethylpyridine-4-carboxamide
CID 43090789

Frequently Asked Questions

What is the IUPAC name of N-butyl-N-ethyl-1H-indazole-6-carboxamide?
The IUPAC name of N-butyl-N-ethyl-1H-indazole-6-carboxamide (CID 55023829) is N-butyl-N-ethyl-1H-indazole-6-carboxamide.
What is the SMILES notation for N-butyl-N-ethyl-1H-indazole-6-carboxamide?
The canonical SMILES for N-butyl-N-ethyl-1H-indazole-6-carboxamide is CCCCN(CC)C(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N-butyl-N-ethyl-1H-indazole-6-carboxamide?
The InChIKey is HAAYUOWPGMGEFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O/c1-3-5-8-17(4-2)14(18)11-6-7-12-10-15-16-13(12)9-11/h6-7,9-10H,3-5,8H2,1-2H3,(H,15,16).
What are the key properties of N-butyl-N-ethyl-1H-indazole-6-carboxamide?
N-butyl-N-ethyl-1H-indazole-6-carboxamide has a molecular weight of 245.33 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-ethyl-1H-indazole-6-carboxamide is sourced from PubChem (CID 55023829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).