N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

C26H27F2N9O2 — CID 175682842

IUPACN-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ncc(-c2nnn(CC3CC3)n2)cc1NC(=O)c1cnn2ccc(N3CC4(C3)CC(O)(C(F)F)C4)cc12
InChIInChI=1S/C26H27F2N9O2/c1-15-20(6-17(8-29-15)22-32-34-37(33-22)10-16-2-3-16)31-23(38)19-9-30-36-5-4-18(7-21(19)36)35-13-25(14-35)11-26(39,12-25)24(27)28/h4-9,16,24,39H,2-3,10-14H2,1H3,(H,31,38)
InChIKeyUANVPRSZGZEOBQ-UHFFFAOYSA-N
MW535.56 g/mol
LogP2.95
Rot. Bonds7

About N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 175682842) has the molecular formula C26H27F2N9O2 and a molecular weight of 535.56 g/mol. Its IUPAC name is N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID175682842
Molecular FormulaC26H27F2N9O2
Molecular Weight535.56 g/mol
Exact Mass535.23
IUPAC NameN-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1ncc(-c2nnn(CC3CC3)n2)cc1NC(=O)c1cnn2ccc(N3CC4(C3)CC(O)(C(F)F)C4)cc12
InChIInChI=1S/C26H27F2N9O2/c1-15-20(6-17(8-29-15)22-32-34-37(33-22)10-16-2-3-16)31-23(38)19-9-30-36-5-4-18(7-21(19)36)35-13-25(14-35)11-26(39,12-25)24(27)28/h4-9,16,24,39H,2-3,10-14H2,1H3,(H,31,38)
InChIKeyUANVPRSZGZEOBQ-UHFFFAOYSA-N
XLogP2.95
TPSA126.36 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500535.56
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 175682842) is N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1ncc(-c2nnn(CC3CC3)n2)cc1NC(=O)c1cnn2ccc(N3CC4(C3)CC(O)(C(F)F)C4)cc12.
What is the InChIKey of N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is UANVPRSZGZEOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H27F2N9O2/c1-15-20(6-17(8-29-15)22-32-34-37(33-22)10-16-2-3-16)31-23(38)19-9-30-36-5-4-18(7-21(19)36)35-13-25(14-35)11-26(39,12-25)24(27)28/h4-9,16,24,39H,2-3,10-14H2,1H3,(H,31,38).
What are the key properties of N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 535.56 g/mol, XLogP of 2.95, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(cyclopropylmethyl)tetrazol-5-yl]-2-methyl-3-pyridinyl]-5-[6-(difluoromethyl)-6-hydroxy-2-azaspiro[3.3]heptan-2-yl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 175682842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).