N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

C20H21F2N5O3 — CID 164606055

IUPACN-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1onc(O[C@@H]2CN[C@H](C(F)F)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1
InChIInChI=1S/C20H21F2N5O3/c1-10-17(20(26-30-10)29-14-8-15(18(21)22)23-9-14)12-4-5-27-13(6-12)7-16(25-27)24-19(28)11-2-3-11/h4-7,11,14-15,18,23H,2-3,8-9H2,1H3,(H,24,25,28)/t14-,15-/m0/s1
InChIKeyMWPZAMCQBXDBGO-GJZGRUSLSA-N
MW417.42 g/mol
LogP3.02
Rot. Bonds6

About N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide

N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (PubChem CID 164606055) has the molecular formula C20H21F2N5O3 and a molecular weight of 417.42 g/mol. Its IUPAC name is N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
PubChem CID164606055
Molecular FormulaC20H21F2N5O3
Molecular Weight417.42 g/mol
Exact Mass417.16
IUPAC NameN-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide
SMILESCc1onc(O[C@@H]2CN[C@H](C(F)F)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1
InChIInChI=1S/C20H21F2N5O3/c1-10-17(20(26-30-10)29-14-8-15(18(21)22)23-9-14)12-4-5-27-13(6-12)7-16(25-27)24-19(28)11-2-3-11/h4-7,11,14-15,18,23H,2-3,8-9H2,1H3,(H,24,25,28)/t14-,15-/m0/s1
InChIKeyMWPZAMCQBXDBGO-GJZGRUSLSA-N
XLogP3.02
TPSA93.69 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.42
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The IUPAC name of N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide (CID 164606055) is N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is Cc1onc(O[C@@H]2CN[C@H](C(F)F)C2)c1-c1ccn2nc(NC(=O)C3CC3)cc2c1.
What is the InChIKey of N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
The InChIKey is MWPZAMCQBXDBGO-GJZGRUSLSA-N. The full InChI is InChI=1S/C20H21F2N5O3/c1-10-17(20(26-30-10)29-14-8-15(18(21)22)23-9-14)12-4-5-27-13(6-12)7-16(25-27)24-19(28)11-2-3-11/h4-7,11,14-15,18,23H,2-3,8-9H2,1H3,(H,24,25,28)/t14-,15-/m0/s1.
What are the key properties of N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide?
N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide has a molecular weight of 417.42 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-[(3S,5S)-5-(difluoromethyl)pyrrolidin-3-yl]oxy-5-methyl-1,2-oxazol-4-yl]pyrazolo[1,5-a]pyridin-2-yl]cyclopropanecarboxamide is sourced from PubChem (CID 164606055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).