N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide

C20H22F2N4OS — CID 143938761

IUPACN-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
SMILESCC(C)c1sc(C(=O)N[C@@H]2CCCCC2(F)F)nc1-c1cnn2ccccc12
InChIInChI=1S/C20H22F2N4OS/c1-12(2)17-16(13-11-23-26-10-6-4-7-14(13)26)25-19(28-17)18(27)24-15-8-3-5-9-20(15,21)22/h4,6-7,10-12,15H,3,5,8-9H2,1-2H3,(H,24,27)/t15-/m1/s1
InChIKeyMIKZWAFZBURBNT-OAHLLOKOSA-N
MW404.49 g/mol
LogP4.89
Rot. Bonds4

About N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide

N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide (PubChem CID 143938761) has the molecular formula C20H22F2N4OS and a molecular weight of 404.49 g/mol. Its IUPAC name is N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
PubChem CID143938761
Molecular FormulaC20H22F2N4OS
Molecular Weight404.49 g/mol
Exact Mass404.15
IUPAC NameN-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
SMILESCC(C)c1sc(C(=O)N[C@@H]2CCCCC2(F)F)nc1-c1cnn2ccccc12
InChIInChI=1S/C20H22F2N4OS/c1-12(2)17-16(13-11-23-26-10-6-4-7-14(13)26)25-19(28-17)18(27)24-15-8-3-5-9-20(15,21)22/h4,6-7,10-12,15H,3,5,8-9H2,1-2H3,(H,24,27)/t15-/m1/s1
InChIKeyMIKZWAFZBURBNT-OAHLLOKOSA-N
XLogP4.89
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500404.49
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide with MolForge

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Related Compounds

N-[(1R,6S)-6-amino-2,2-difluorocyclohexyl]-5-methyl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
CID 58385870
4-(5-carbamoylpyrazolo[1,5-a]pyridin-3-yl)-5-chloro-N-[(1R)-2,2-difluorocyclohexyl]-1,3-thiazole-2-carboxamide
CID 162586975
N-[(1R,6S)-6-amino-2,2-difluorocyclohexyl]-5-prop-1-en-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
CID 58385932
N-[(1R,6R)-6-amino-2,2-difluorocyclohexyl]-5-(2-cyclopropylethynyl)-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
CID 58385875
tert-butyl N-[2-[(5-bromo-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carbonyl)amino]-3,3-difluorocyclohexyl]carbamate
CID 162559287
N-(2-aminocyclopentyl)-5-chloro-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
CID 76773123
N-(3-aminocyclohexyl)-5-chloro-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide
CID 44816673
2-[(1R,6R)-6-amino-2,2-difluorocyclohexyl]-1-(5-chloro-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazol-2-yl)ethanone
CID 58385896
N-(6-amino-2,2-difluorocyclohexyl)-5-chloro-4-(5-methylpyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-2-carboxamide
CID 75075572
N-[(1R,6R)-6-amino-2,2-difluorocyclohexyl]-5-chloro-4-pyrazolo[1,5-a]pyridin-3-ylthiophene-2-carboxamide
CID 58386003
N-[(1R,6R)-6-amino-2,2-difluorocyclohexyl]-4-(6-chloropyrazolo[1,5-a]pyridin-3-yl)-5-methyl-1,3-thiazole-2-carboxamide
CID 67349719
N-(6-amino-2,2-difluorocyclohexyl)-5-chloro-4-(6-iodopyrazolo[1,5-a]pyridin-3-yl)-1,3-thiazole-2-carboxamide
CID 75075568

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide?
The IUPAC name of N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide (CID 143938761) is N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide is CC(C)c1sc(C(=O)N[C@@H]2CCCCC2(F)F)nc1-c1cnn2ccccc12.
What is the InChIKey of N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide?
The InChIKey is MIKZWAFZBURBNT-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H22F2N4OS/c1-12(2)17-16(13-11-23-26-10-6-4-7-14(13)26)25-19(28-17)18(27)24-15-8-3-5-9-20(15,21)22/h4,6-7,10-12,15H,3,5,8-9H2,1-2H3,(H,24,27)/t15-/m1/s1.
What are the key properties of N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide?
N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide has a molecular weight of 404.49 g/mol, XLogP of 4.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-2,2-difluorocyclohexyl]-5-propan-2-yl-4-pyrazolo[1,5-a]pyridin-3-yl-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 143938761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).