4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide

C20H15N5O2 — CID 170562682

IUPAC4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2ccc3[nH]nc(-c4cccnc4)c3c2)cc1
InChIInChI=1S/C20H15N5O2/c21-19(26)12-3-5-13(6-4-12)20(27)23-15-7-8-17-16(10-15)18(25-24-17)14-2-1-9-22-11-14/h1-11H,(H2,21,26)(H,23,27)(H,24,25)
InChIKeyBMDIKKROPRIWIW-UHFFFAOYSA-N
MW357.37 g/mol
LogP2.98
Rot. Bonds4

About 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide

4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide (PubChem CID 170562682) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide
PubChem CID170562682
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC Name4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide
SMILESNC(=O)c1ccc(C(=O)Nc2ccc3[nH]nc(-c4cccnc4)c3c2)cc1
InChIInChI=1S/C20H15N5O2/c21-19(26)12-3-5-13(6-4-12)20(27)23-15-7-8-17-16(10-15)18(25-24-17)14-2-1-9-22-11-14/h1-11H,(H2,21,26)(H,23,27)(H,24,25)
InChIKeyBMDIKKROPRIWIW-UHFFFAOYSA-N
XLogP2.98
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 52.98
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-carbamoylphenyl)-3-pyridin-3-yl-1H-pyrazole-5-carboxamide
CID 71828964
4-N-[3-(3-nitrophenyl)-1H-indazol-5-yl]benzene-1,4-dicarboxamide
CID 170562674
4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]benzoic acid
CID 22479735
3-[3-[(3,5-dichlorobenzoyl)amino]phenyl]-1H-indazole-5-carboxamide
CID 58863539
2-[4-[(3-phenyl-1H-indazol-5-yl)carbamoyl]phenyl]acetic acid
CID 142112726
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
CID 22479938
N-(1H-indol-5-yl)-4-pyridin-3-ylbenzamide
CID 59673715
N-(3-chlorophenyl)-3-phenyl-1H-indazole-5-carboxamide
CID 162666626
methyl 4-[[3-(4-fluorophenyl)-1H-indazol-5-yl]carbamoyl]benzoate
CID 22479901
4-[[3-(4-methoxyphenyl)-1H-indazol-5-yl]carbamoyl]benzoic acid
CID 22479778
4-(carbamoylamino)-N-pyridin-3-ylbenzamide
CID 13387851
4-(1H-indazol-3-yl)-N-phenylbenzamide
CID 146637903

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide?
The IUPAC name of 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide (CID 170562682) is 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide?
The canonical SMILES for 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide is NC(=O)c1ccc(C(=O)Nc2ccc3[nH]nc(-c4cccnc4)c3c2)cc1.
What is the InChIKey of 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide?
The InChIKey is BMDIKKROPRIWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c21-19(26)12-3-5-13(6-4-12)20(27)23-15-7-8-17-16(10-15)18(25-24-17)14-2-1-9-22-11-14/h1-11H,(H2,21,26)(H,23,27)(H,24,25).
What are the key properties of 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide?
4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide has a molecular weight of 357.37 g/mol, XLogP of 2.98, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-pyridin-3-yl-1H-indazol-5-yl)benzene-1,4-dicarboxamide is sourced from PubChem (CID 170562682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).