N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide

C14H10Cl2N4O — CID 11666910

IUPACN-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide
SMILESNc1n[nH]c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc12
InChIInChI=1S/C14H10Cl2N4O/c15-7-1-3-9(11(16)5-7)14(21)18-8-2-4-12-10(6-8)13(17)20-19-12/h1-6H,(H,18,21)(H3,17,19,20)
InChIKeyLWNNUQOMTSSIHJ-UHFFFAOYSA-N
MW321.17 g/mol
LogP3.70
Rot. Bonds2

About N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide

N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide (PubChem CID 11666910) has the molecular formula C14H10Cl2N4O and a molecular weight of 321.17 g/mol. Its IUPAC name is N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide.

Molecular Properties

Compound NameN-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide
PubChem CID11666910
Molecular FormulaC14H10Cl2N4O
Molecular Weight321.17 g/mol
Exact Mass320.02
IUPAC NameN-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide
SMILESNc1n[nH]c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc12
InChIInChI=1S/C14H10Cl2N4O/c15-7-1-3-9(11(16)5-7)14(21)18-8-2-4-12-10(6-8)13(17)20-19-12/h1-6H,(H,18,21)(H3,17,19,20)
InChIKeyLWNNUQOMTSSIHJ-UHFFFAOYSA-N
XLogP3.70
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.17
LogP ≤ 53.70
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-1H-indazol-5-yl)-2,5-dichlorobenzamide
CID 155557901
2,4-dichloro-N-(1H-indol-5-yl)benzamide
CID 171571914
N-(4-acetamidophenyl)-2,4-dichlorobenzamide
CID 786004
2,4-dichloro-N-(4-sulfanylphenyl)benzamide
CID 143459356
2,4-dichloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 63252988
5-chloro-N-[4-(2H-tetrazol-5-yl)phenyl]-1H-indazole-3-carboxamide
CID 10404956
4-[(2-amino-4-chlorobenzoyl)amino]-2-chlorobenzamide
CID 62057564
5-chloro-N-(6-chloro-3-pyridinyl)-1H-indazole-3-carboxamide
CID 11449640
N-[4-(1-aminoethyl)phenyl]-2,4-dichlorobenzamide
CID 43321115
N-(2-tert-butyl-4-pyridinyl)-2,4-dichlorobenzamide
CID 110443054
2,4-dichloro-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283086
N-(3-amino-4-pyrrolidin-1-ylphenyl)-2,4-dichlorobenzamide
CID 91676429

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide?
The IUPAC name of N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide (CID 11666910) is N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide.
What is the SMILES notation for N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide?
The canonical SMILES for N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide is Nc1n[nH]c2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc12.
What is the InChIKey of N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide?
The InChIKey is LWNNUQOMTSSIHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2N4O/c15-7-1-3-9(11(16)5-7)14(21)18-8-2-4-12-10(6-8)13(17)20-19-12/h1-6H,(H,18,21)(H3,17,19,20).
What are the key properties of N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide?
N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide has a molecular weight of 321.17 g/mol, XLogP of 3.70, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-1H-indazol-5-yl)-2,4-dichlorobenzamide is sourced from PubChem (CID 11666910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).