N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide

C18H13ClN4OS — CID 156886673

IUPACN-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide
SMILESO=C(NCc1ccc(Cl)s1)c1cccc2c(-c3ccncc3)n[nH]c12
InChIInChI=1S/C18H13ClN4OS/c19-15-5-4-12(25-15)10-21-18(24)14-3-1-2-13-16(22-23-17(13)14)11-6-8-20-9-7-11/h1-9H,10H2,(H,21,24)(H,22,23)
InChIKeyIUYQPJFZHXEJMN-UHFFFAOYSA-N
MW368.85 g/mol
LogP4.27
Rot. Bonds4

About N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide

N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide (PubChem CID 156886673) has the molecular formula C18H13ClN4OS and a molecular weight of 368.85 g/mol. Its IUPAC name is N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide.

Molecular Properties

Compound NameN-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide
PubChem CID156886673
Molecular FormulaC18H13ClN4OS
Molecular Weight368.85 g/mol
Exact Mass368.05
IUPAC NameN-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide
SMILESO=C(NCc1ccc(Cl)s1)c1cccc2c(-c3ccncc3)n[nH]c12
InChIInChI=1S/C18H13ClN4OS/c19-15-5-4-12(25-15)10-21-18(24)14-3-1-2-13-16(22-23-17(13)14)11-6-8-20-9-7-11/h1-9H,10H2,(H,21,24)(H,22,23)
InChIKeyIUYQPJFZHXEJMN-UHFFFAOYSA-N
XLogP4.27
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.85
LogP ≤ 54.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-chlorothiophen-2-yl)methyl]-2,3-dihydroxybenzamide
CID 114344423
N-[(5-chlorothiophen-2-yl)methyl]-2-phenylbenzamide
CID 33177904
2-amino-3-chloro-N-[(5-chlorothiophen-2-yl)methyl]benzamide
CID 115540742
N-[(5-methylthiophen-2-yl)methyl]-2-pyridin-4-ylquinoline-4-carboxamide
CID 55794770
N-[(6-ethyl-3-pyridinyl)methyl]-3-pyridazin-4-yl-1H-indazole-7-carboxamide
CID 170203956
N-[(1R)-1-(4-chlorophenyl)ethyl]-N-iodo-3-pyridin-4-yl-1H-indazole-7-carboxamide
CID 170204208
N-[(5-chlorothiophen-2-yl)methyl]-3,5-dimethyl-1H-pyrazole-4-carboxamide
CID 63652849
N-[(5-chlorothiophen-2-yl)methyl]-6-oxo-1H-pyridine-2-carboxamide
CID 107261709
N-[(5-chlorothiophen-2-yl)methyl]-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 32829207
3-bromo-N-[(5-chlorothiophen-2-yl)methyl]pyridine-2-carboxamide
CID 107519034
N-[(5-chlorothiophen-2-yl)methyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 32826150
N-[(5-chlorothiophen-2-yl)methyl]-2-(3-cyanophenoxy)pyridine-3-carboxamide
CID 22612427

Frequently Asked Questions

What is the IUPAC name of N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide?
The IUPAC name of N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide (CID 156886673) is N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide.
What is the SMILES notation for N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide?
The canonical SMILES for N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide is O=C(NCc1ccc(Cl)s1)c1cccc2c(-c3ccncc3)n[nH]c12.
What is the InChIKey of N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide?
The InChIKey is IUYQPJFZHXEJMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13ClN4OS/c19-15-5-4-12(25-15)10-21-18(24)14-3-1-2-13-16(22-23-17(13)14)11-6-8-20-9-7-11/h1-9H,10H2,(H,21,24)(H,22,23).
What are the key properties of N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide?
N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide has a molecular weight of 368.85 g/mol, XLogP of 4.27, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chlorothiophen-2-yl)methyl]-3-pyridin-4-yl-1H-indazole-7-carboxamide is sourced from PubChem (CID 156886673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).