N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide

C11H12N4O — CID 141183520

IUPACN-(dimethylaminomethylidene)-1H-indazole-5-carboxamide
SMILESCN(C)/C=N/C(=O)c1ccc2[nH]ncc2c1
InChIInChI=1S/C11H12N4O/c1-15(2)7-12-11(16)8-3-4-10-9(5-8)6-13-14-10/h3-7H,1-2H3,(H,13,14)/b12-7+
InChIKeyJNLWMLPNVRQTMG-KPKJPENVSA-N
MW216.24 g/mol
LogP1.29
Rot. Bonds2

About N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide

N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide (PubChem CID 141183520) has the molecular formula C11H12N4O and a molecular weight of 216.24 g/mol. Its IUPAC name is N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide.

Molecular Properties

Compound NameN-(dimethylaminomethylidene)-1H-indazole-5-carboxamide
PubChem CID141183520
Molecular FormulaC11H12N4O
Molecular Weight216.24 g/mol
Exact Mass216.10
IUPAC NameN-(dimethylaminomethylidene)-1H-indazole-5-carboxamide
SMILESCN(C)/C=N/C(=O)c1ccc2[nH]ncc2c1
InChIInChI=1S/C11H12N4O/c1-15(2)7-12-11(16)8-3-4-10-9(5-8)6-13-14-10/h3-7H,1-2H3,(H,13,14)/b12-7+
InChIKeyJNLWMLPNVRQTMG-KPKJPENVSA-N
XLogP1.29
TPSA61.35 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-1H-indazole-5-carboxamide
CID 22934041
N'-amino-1H-indazole-5-carboximidamide
CID 69029061
(NE)-N-[1-(1H-indazol-5-yl)ethylidene]hydroxylamine
CID 87086002
N-tert-butyl-1H-indazole-5-carboxamide
CID 22933425
N-cyclopentyl-4-(1H-indazol-5-yl)-N-methylbenzamide
CID 129191428
N-(1H-indazol-5-yl)-4-methylbenzamide
CID 17163732
N-cyano-1H-indazole-5-carboxamide
CID 79195271
N-(2-hydroxy-3-methoxypropyl)-N-methyl-1H-indazole-5-carboxamide
CID 54993384
[(3R,5S)-3,5-dimethylpiperazin-1-yl]-(1H-indazol-5-yl)methanone
CID 124589837
N-[(2R)-1-hydroxypropan-2-yl]-1H-indazole-5-carboxamide
CID 79027801
(NE,S)-N-[1-(1H-indazol-5-yl)ethylidene]-2-methylpropane-2-sulfinamide
CID 87212835
2-[1H-indazol-5-yl(methyl)amino]acetic acid
CID 83819829

Frequently Asked Questions

What is the IUPAC name of N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide?
The IUPAC name of N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide (CID 141183520) is N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide.
What is the SMILES notation for N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide?
The canonical SMILES for N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide is CN(C)/C=N/C(=O)c1ccc2[nH]ncc2c1.
What is the InChIKey of N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide?
The InChIKey is JNLWMLPNVRQTMG-KPKJPENVSA-N. The full InChI is InChI=1S/C11H12N4O/c1-15(2)7-12-11(16)8-3-4-10-9(5-8)6-13-14-10/h3-7H,1-2H3,(H,13,14)/b12-7+.
What are the key properties of N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide?
N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide has a molecular weight of 216.24 g/mol, XLogP of 1.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(dimethylaminomethylidene)-1H-indazole-5-carboxamide is sourced from PubChem (CID 141183520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).