N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide

C12H13N5O3 — CID 62923706

IUPACN,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide
SMILESNC(=O)CN(CC(N)=O)C(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C12H13N5O3/c13-10(18)5-17(6-11(14)19)12(20)7-1-2-8-4-15-16-9(8)3-7/h1-4H,5-6H2,(H2,13,18)(H2,14,19)(H,15,16)
InChIKeyGYAPAZDTUOOHNW-UHFFFAOYSA-N
MW275.27 g/mol
LogP-1.02
Rot. Bonds5

About N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide

N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide (PubChem CID 62923706) has the molecular formula C12H13N5O3 and a molecular weight of 275.27 g/mol. Its IUPAC name is N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide.

Molecular Properties

Compound NameN,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide
PubChem CID62923706
Molecular FormulaC12H13N5O3
Molecular Weight275.27 g/mol
Exact Mass275.10
IUPAC NameN,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide
SMILESNC(=O)CN(CC(N)=O)C(=O)c1ccc2cn[nH]c2c1
InChIInChI=1S/C12H13N5O3/c13-10(18)5-17(6-11(14)19)12(20)7-1-2-8-4-15-16-9(8)3-7/h1-4H,5-6H2,(H2,13,18)(H2,14,19)(H,15,16)
InChIKeyGYAPAZDTUOOHNW-UHFFFAOYSA-N
XLogP-1.02
TPSA135.17 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 5-1.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-N-ethyl-1H-indazole-6-carboxamide
CID 55023829
N-methyl-N-(2-methylbutan-2-yl)-1H-indazole-6-carboxamide
CID 63960134
N-(2-hydroxyethyl)-N-methyl-1H-indazole-6-carboxamide
CID 60960458
N-(2-amino-2-oxoethoxy)-1H-indazole-6-carboxamide
CID 112674427
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-1H-indazole-6-carboxamide
CID 60724448
N-(2-cyanoethyl)-N-(2-methoxyethyl)-1H-indazole-6-carboxamide
CID 63286734
N-cyclopentyl-N-ethyl-1H-indazole-6-carboxamide
CID 62905257
N-(3-hydroxyphenyl)-N-methyl-1H-indazole-6-carboxamide
CID 107735897
3-N-(1H-indazol-6-yl)-3-N-propylbenzene-1,3-dicarboxamide
CID 177246462
N-(2-thiophen-2-ylethyl)-1H-indazole-6-carboxamide
CID 60714994
N-[(3R,4R)-4-hydroxypyrrolidin-3-yl]-N-methyl-1H-indazole-6-carboxamide
CID 62919735
N-ethyl-N-(3-fluorophenyl)-1H-indazole-6-carboxamide
CID 62905806

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide?
The IUPAC name of N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide (CID 62923706) is N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide.
What is the SMILES notation for N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide?
The canonical SMILES for N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide is NC(=O)CN(CC(N)=O)C(=O)c1ccc2cn[nH]c2c1.
What is the InChIKey of N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide?
The InChIKey is GYAPAZDTUOOHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N5O3/c13-10(18)5-17(6-11(14)19)12(20)7-1-2-8-4-15-16-9(8)3-7/h1-4H,5-6H2,(H2,13,18)(H2,14,19)(H,15,16).
What are the key properties of N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide?
N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide has a molecular weight of 275.27 g/mol, XLogP of -1.02, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-amino-2-oxoethyl)-1H-indazole-6-carboxamide is sourced from PubChem (CID 62923706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).