N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

C23H26N8O3 — CID 146570099

IUPACN-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(-c2ccc(N3CCCC3)c3nccn23)nc2c(C(=O)NC3COC[C@H]3O)cnn12
InChIInChI=1S/C23H26N8O3/c1-24-20-10-15(17-4-5-18(29-7-2-3-8-29)22-25-6-9-30(17)22)27-21-14(11-26-31(20)21)23(33)28-16-12-34-13-19(16)32/h4-6,9-11,16,19,24,32H,2-3,7-8,12-13H2,1H3,(H,28,33)/t16?,19-/m1/s1
InChIKeyQOXXUPHOOZPXMP-LRTDYKAYSA-N
MW462.51 g/mol
LogP1.18
Rot. Bonds5

About N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide

N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 146570099) has the molecular formula C23H26N8O3 and a molecular weight of 462.51 g/mol. Its IUPAC name is N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID146570099
Molecular FormulaC23H26N8O3
Molecular Weight462.51 g/mol
Exact Mass462.21
IUPAC NameN-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCNc1cc(-c2ccc(N3CCCC3)c3nccn23)nc2c(C(=O)NC3COC[C@H]3O)cnn12
InChIInChI=1S/C23H26N8O3/c1-24-20-10-15(17-4-5-18(29-7-2-3-8-29)22-25-6-9-30(17)22)27-21-14(11-26-31(20)21)23(33)28-16-12-34-13-19(16)32/h4-6,9-11,16,19,24,32H,2-3,7-8,12-13H2,1H3,(H,28,33)/t16?,19-/m1/s1
InChIKeyQOXXUPHOOZPXMP-LRTDYKAYSA-N
XLogP1.18
TPSA121.32 Ų
H-Bond Donors3
H-Bond Acceptors10
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500462.51
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1010

Analyze N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

N-[(3R,4R)-4-hydroxyoxolan-3-yl]-5-[8-[(3S)-3-methoxypyrrolidin-1-yl]imidazo[1,2-a]pyridin-5-yl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146569578
N-[(2R)-2-hydroxycyclopentyl]-5-[8-[(3S)-3-methoxypyrrolidin-1-yl]imidazo[1,2-a]pyridin-5-yl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167666701
5-[8-[(3S)-3-methoxypyrrolidin-1-yl]imidazo[1,2-a]pyridin-5-yl]-7-(methylamino)-N-[(1R,2S)-2-methylcyclopropyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 167666700
N-[(1R,2S)-2-fluorocyclopropyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146560788
N-[(1R,2R)-2-fluorocyclobutyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146572539
N-[(2S)-2-methoxycyclobutyl]-7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146569662
5-[1-[(1S,2R)-2-fluorocyclopentyl]pyrrolo[2,3-b]pyridin-3-yl]-N-(4-hydroxyoxolan-3-yl)-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146560459
7-(methylamino)-5-[8-(methylamino)imidazo[1,2-a]pyridin-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146569521
N-[(3R,4R)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146572553
5-[1-[(3R,4R)-4-fluorooxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]-N-[(3R,4R)-4-hydroxyoxolan-3-yl]-7-(methylamino)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146569541
N-[(4R)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146560456
N-(4-hydroxyoxolan-3-yl)-7-(methylamino)-5-[1-[(3S)-oxolan-3-yl]pyrrolo[2,3-b]pyridin-3-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 146560438

Frequently Asked Questions

What is the IUPAC name of N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 146570099) is N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is CNc1cc(-c2ccc(N3CCCC3)c3nccn23)nc2c(C(=O)NC3COC[C@H]3O)cnn12.
What is the InChIKey of N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is QOXXUPHOOZPXMP-LRTDYKAYSA-N. The full InChI is InChI=1S/C23H26N8O3/c1-24-20-10-15(17-4-5-18(29-7-2-3-8-29)22-25-6-9-30(17)22)27-21-14(11-26-31(20)21)23(33)28-16-12-34-13-19(16)32/h4-6,9-11,16,19,24,32H,2-3,7-8,12-13H2,1H3,(H,28,33)/t16?,19-/m1/s1.
What are the key properties of N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 462.51 g/mol, XLogP of 1.18, 5 rotatable bonds, 3 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-4-hydroxyoxolan-3-yl]-7-(methylamino)-5-(8-pyrrolidin-1-ylimidazo[1,2-a]pyridin-5-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 146570099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).