N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide

C26H34N6O4 — CID 139425648

IUPACN-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNc1cc(Nc2cccn(C3CCC(C)(OC)CC3)c2=O)cc2c(C(=O)NC3CCC3O)cnn12
InChIInChI=1S/C26H34N6O4/c1-26(36-3)10-8-17(9-11-26)31-12-4-5-20(25(31)35)29-16-13-21-18(15-28-32(21)23(14-16)27-2)24(34)30-19-6-7-22(19)33/h4-5,12-15,17,19,22,27,29,33H,6-11H2,1-3H3,(H,30,34)
InChIKeyLSOKVMIXAAVQAE-UHFFFAOYSA-N
MW494.60 g/mol
LogP3.05
Rot. Bonds7

About N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide

N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 139425648) has the molecular formula C26H34N6O4 and a molecular weight of 494.60 g/mol. Its IUPAC name is N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID139425648
Molecular FormulaC26H34N6O4
Molecular Weight494.60 g/mol
Exact Mass494.26
IUPAC NameN-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCNc1cc(Nc2cccn(C3CCC(C)(OC)CC3)c2=O)cc2c(C(=O)NC3CCC3O)cnn12
InChIInChI=1S/C26H34N6O4/c1-26(36-3)10-8-17(9-11-26)31-12-4-5-20(25(31)35)29-16-13-21-18(15-28-32(21)23(14-16)27-2)24(34)30-19-6-7-22(19)33/h4-5,12-15,17,19,22,27,29,33H,6-11H2,1-3H3,(H,30,34)
InChIKeyLSOKVMIXAAVQAE-UHFFFAOYSA-N
XLogP3.05
TPSA121.92 Ų
H-Bond Donors4
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.60
LogP ≤ 53.05
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 109

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Related Compounds

N-[(1S,2S)-2-hydroxycyclobutyl]-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450076
3-[[3-[[[(1R,2S)-2-hydroxycyclobutyl]amino]methyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidin-5-yl]amino]-1-(4-methoxy-4-methylcyclohexyl)pyridin-2-one;N-[(1S,2R)-2-hydroxycyclobutyl]-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide;bis(N-[(2R)-2-hydroxycyclobutyl]-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide)
CID 158181917
5-[(1-cyclopropyl-2-oxo-3-pyridinyl)amino]-N-(2-hydroxycyclobutyl)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 142524002
5-[[1-(3-fluorocyclobutyl)-2-oxo-3-pyridinyl]amino]-N-[(2R)-2-hydroxycyclobutyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146559146
N-[(1R,2S)-2-hydroxycyclobutyl]-7-(methylamino)-5-[[1-(2-oxaspiro[3.3]heptan-6-yl)-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146383343
N-[(1S,2R)-2-hydroxy-2-methylcyclobutyl]-7-(methylamino)-5-[(2-oxo-1-propan-2-yl-3-pyridinyl)amino]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 146426592
N-[(1S,2S)-2-hydroxycyclobutyl]-5-[[1-[(2R)-2-methoxycyclobutyl]-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146559137
N-[(1S,2R)-2-fluorocyclopropyl]-5-[[1-(4-hydroxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450124
N-[(2S)-2-hydroxycyclobutyl]-7-(methylamino)-5-[[1-[(3S)-oxan-3-yl]-2-oxo-3-pyridinyl]amino]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450029
5-[[1-[(1R,2R)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-N-[(1S,2S)-2-hydroxycyclobutyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 137450055
tert-butyl N-[5-[[1-[(1S,2S)-2-fluorocyclopropyl]-2-oxo-3-pyridinyl]amino]-3-[(2-hydroxycyclobutyl)carbamoyl]pyrazolo[1,5-a]pyridin-7-yl]-N-methylcarbamate
CID 139425536
5-[[1-[(1R,2S)-2-hydroxycyclobutyl]-2-oxo-3-pyridinyl]amino]-N-[(2S)-2-methoxy-2-methylcyclobutyl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 153486334

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide (CID 139425648) is N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide is CNc1cc(Nc2cccn(C3CCC(C)(OC)CC3)c2=O)cc2c(C(=O)NC3CCC3O)cnn12.
What is the InChIKey of N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is LSOKVMIXAAVQAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N6O4/c1-26(36-3)10-8-17(9-11-26)31-12-4-5-20(25(31)35)29-16-13-21-18(15-28-32(21)23(14-16)27-2)24(34)30-19-6-7-22(19)33/h4-5,12-15,17,19,22,27,29,33H,6-11H2,1-3H3,(H,30,34).
What are the key properties of N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide?
N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 494.60 g/mol, XLogP of 3.05, 7 rotatable bonds, 4 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxycyclobutyl)-5-[[1-(4-methoxy-4-methylcyclohexyl)-2-oxo-3-pyridinyl]amino]-7-(methylamino)pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 139425648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).