5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide

C20H15N7O — CID 170346800

IUPAC5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1nc(-c2cccc(C#N)c2)nc(C(N)=O)c1N
InChIInChI=1S/C20H15N7O/c1-10-5-6-14-13(9-24-27-14)15(10)17-16(22)18(19(23)28)26-20(25-17)12-4-2-3-11(7-12)8-21/h2-7,9H,22H2,1H3,(H2,23,28)(H,24,27)
InChIKeyLBYBNQHOSZNGTJ-UHFFFAOYSA-N
MW369.39 g/mol
LogP2.55
Rot. Bonds3

About 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide

5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide (PubChem CID 170346800) has the molecular formula C20H15N7O and a molecular weight of 369.39 g/mol. Its IUPAC name is 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide.

Molecular Properties

Compound Name5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide
PubChem CID170346800
Molecular FormulaC20H15N7O
Molecular Weight369.39 g/mol
Exact Mass369.13
IUPAC Name5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1nc(-c2cccc(C#N)c2)nc(C(N)=O)c1N
InChIInChI=1S/C20H15N7O/c1-10-5-6-14-13(9-24-27-14)15(10)17-16(22)18(19(23)28)26-20(25-17)12-4-2-3-11(7-12)8-21/h2-7,9H,22H2,1H3,(H2,23,28)(H,24,27)
InChIKeyLBYBNQHOSZNGTJ-UHFFFAOYSA-N
XLogP2.55
TPSA147.36 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.39
LogP ≤ 52.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

ethyl 2-[3-[5-amino-4-carbamoyl-6-(5-methyl-1H-indazol-4-yl)pyrimidin-2-yl]phenoxy]acetate
CID 177283420
5-amino-6-(5-methyl-1H-indazol-4-yl)-2-(4-methylthiophen-2-yl)pyrimidine-4-carboxamide
CID 177283645
5-amino-6-(5-methyl-1H-indazol-4-yl)-2-[4-(4-methylpiperazin-1-yl)phenyl]pyrimidine-4-carboxamide
CID 177283695
5-amino-6-(5-methyl-1H-indazol-4-yl)-2-(2-propylphenyl)pyrimidine-4-carboxamide
CID 177283432
5-amino-2-[2-[(1,1-dioxothietan-3-yl)amino]-5-fluorophenyl]-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide
CID 170346531
6-(5-methyl-1H-indazol-4-yl)-2-phenylpyrimidine-4-carboxylic acid
CID 170346575
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 177283554
7-(5-methyl-1H-indazol-4-yl)isoquinoline-1-carboxamide
CID 71115097
5-[2-(3-cyanophenyl)phenyl]-2H-triazole-4-carboxamide
CID 169402878
5-amino-2-chloro-6-(1H-indazol-4-yl)pyrimidine-4-carboxamide
CID 170346793
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-(6-morpholin-4-yl-2-pyridinyl)pyridine-2-carboxamide
CID 177283615
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-[6-(1,3-thiazol-5-ylmethoxy)-2-pyridinyl]pyridine-2-carboxamide
CID 177283677

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide?
The IUPAC name of 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide (CID 170346800) is 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide.
What is the SMILES notation for 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide?
The canonical SMILES for 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide is Cc1ccc2[nH]ncc2c1-c1nc(-c2cccc(C#N)c2)nc(C(N)=O)c1N.
What is the InChIKey of 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide?
The InChIKey is LBYBNQHOSZNGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N7O/c1-10-5-6-14-13(9-24-27-14)15(10)17-16(22)18(19(23)28)26-20(25-17)12-4-2-3-11(7-12)8-21/h2-7,9H,22H2,1H3,(H2,23,28)(H,24,27).
What are the key properties of 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide?
5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide has a molecular weight of 369.39 g/mol, XLogP of 2.55, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(3-cyanophenyl)-6-(5-methyl-1H-indazol-4-yl)pyrimidine-4-carboxamide is sourced from PubChem (CID 170346800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).