5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide

C27H27N7O2 — CID 118381614

IUPAC5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccnc(N2CCCCC2)c1)c1n[nH]c2ccc(-c3cncc(NC(=O)C4CC4)c3)cc12
InChIInChI=1S/C27H27N7O2/c35-26(17-4-5-17)31-21-12-19(15-28-16-21)18-6-7-23-22(13-18)25(33-32-23)27(36)30-20-8-9-29-24(14-20)34-10-2-1-3-11-34/h6-9,12-17H,1-5,10-11H2,(H,31,35)(H,32,33)(H,29,30,36)
InChIKeyVQQCAYCXEONHBJ-UHFFFAOYSA-N
MW481.56 g/mol
LogP4.61
Rot. Bonds6

About 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide

5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 118381614) has the molecular formula C27H27N7O2 and a molecular weight of 481.56 g/mol. Its IUPAC name is 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID118381614
Molecular FormulaC27H27N7O2
Molecular Weight481.56 g/mol
Exact Mass481.22
IUPAC Name5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccnc(N2CCCCC2)c1)c1n[nH]c2ccc(-c3cncc(NC(=O)C4CC4)c3)cc12
InChIInChI=1S/C27H27N7O2/c35-26(17-4-5-17)31-21-12-19(15-28-16-21)18-6-7-23-22(13-18)25(33-32-23)27(36)30-20-8-9-29-24(14-20)34-10-2-1-3-11-34/h6-9,12-17H,1-5,10-11H2,(H,31,35)(H,32,33)(H,29,30,36)
InChIKeyVQQCAYCXEONHBJ-UHFFFAOYSA-N
XLogP4.61
TPSA115.90 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.56
LogP ≤ 54.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide with MolForge

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Related Compounds

N-[2-(azetidin-1-yl)-4-pyridinyl]-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381679
N-[2-(azetidin-1-yl)-4-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381971
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89445547
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-[2-(azetidin-1-yl)-4-pyridinyl]-1H-indazole-3-carboxamide
CID 118382339
N-[4-(cyclopropanecarbonylamino)-3-pyridinyl]-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89458576
N-[2-(3,3-difluoroazetidin-1-yl)-4-pyridinyl]-5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382347
N-(6-cyano-3-pyridinyl)-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89450886
N-(3-benzylphenyl)-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89459070
N-[6-(2-cyclopentylacetyl)-3-pyridinyl]-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 148813338
N-[6-(azetidin-1-yl)-3-pyridinyl]-5-(5-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 89450857
N-(6-piperidin-1-yl-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89450862
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-[6-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;ethane
CID 144555302

Frequently Asked Questions

What is the IUPAC name of 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide (CID 118381614) is 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide is O=C(Nc1ccnc(N2CCCCC2)c1)c1n[nH]c2ccc(-c3cncc(NC(=O)C4CC4)c3)cc12.
What is the InChIKey of 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is VQQCAYCXEONHBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27N7O2/c35-26(17-4-5-17)31-21-12-19(15-28-16-21)18-6-7-23-22(13-18)25(33-32-23)27(36)30-20-8-9-29-24(14-20)34-10-2-1-3-11-34/h6-9,12-17H,1-5,10-11H2,(H,31,35)(H,32,33)(H,29,30,36).
What are the key properties of 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide?
5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 481.56 g/mol, XLogP of 4.61, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-N-(2-piperidin-1-yl-4-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 118381614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).