4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one

C26H30N8O — CID 155282131

IUPAC4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one
SMILESCC1(N)CCN(c2ccc(Nc3nccc(-c4ccn5ncc(C(C)(C)C)c5c4)n3)nc2)C(=O)C1
InChIInChI=1S/C26H30N8O/c1-25(2,3)19-16-30-34-11-8-17(13-21(19)34)20-7-10-28-24(31-20)32-22-6-5-18(15-29-22)33-12-9-26(4,27)14-23(33)35/h5-8,10-11,13,15-16H,9,12,14,27H2,1-4H3,(H,28,29,31,32)
InChIKeyGRGYZHMEKLHYPN-UHFFFAOYSA-N
MW470.58 g/mol
LogP4.07
Rot. Bonds4

About 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one

4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one (PubChem CID 155282131) has the molecular formula C26H30N8O and a molecular weight of 470.58 g/mol. Its IUPAC name is 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one.

Molecular Properties

Compound Name4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one
PubChem CID155282131
Molecular FormulaC26H30N8O
Molecular Weight470.58 g/mol
Exact Mass470.25
IUPAC Name4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one
SMILESCC1(N)CCN(c2ccc(Nc3nccc(-c4ccn5ncc(C(C)(C)C)c5c4)n3)nc2)C(=O)C1
InChIInChI=1S/C26H30N8O/c1-25(2,3)19-16-30-34-11-8-17(13-21(19)34)20-7-10-28-24(31-20)32-22-6-5-18(15-29-22)33-12-9-26(4,27)14-23(33)35/h5-8,10-11,13,15-16H,9,12,14,27H2,1-4H3,(H,28,29,31,32)
InChIKeyGRGYZHMEKLHYPN-UHFFFAOYSA-N
XLogP4.07
TPSA114.33 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.58
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one 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

4-amino-1-[6-[[4-(7-fluorospiro[2H-1-benzofuran-3,1'-cyclopentane]-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one
CID 155282193
4-[2-fluoroethyl(methyl)amino]-1-[6-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]piperidin-2-one
CID 155281861
1-[4-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]phenyl]piperazin-2-one
CID 155281963
1-[3-methyl-4-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]phenyl]piperazin-2-one
CID 155282336
3-(dimethylamino)-1-[4-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]phenyl]pyrrolidin-2-one
CID 155282265
tert-butyl 4-[6-[[4-(7-fluoro-3,3-dimethyl-2H-1-benzofuran-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-3-oxopiperazine-1-carboxylate
CID 155281936
3-(methylamino)-1-[5-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-2-pyridinyl]piperidin-2-one
CID 155282339
1-ethyl-4-[6-[[5-fluoro-4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]piperazine-2,5-dione
CID 155281910
4-ethyl-1-[6-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]-3-pyridinyl]piperazin-2-one
CID 167580077
4-ethyl-1-[6-[[4-(4-methoxy-1-propan-2-ylimidazo[4,5-c]pyridin-6-yl)pyrimidin-2-yl]amino]-3-pyridinyl]piperazin-2-one
CID 155281872
N-(5-piperazin-1-yl-2-pyridinyl)-4-(1,1,5-trimethyl-2,3-dihydropyrrolo[1,2-a]benzimidazol-7-yl)pyrimidin-2-amine
CID 158383331
methane;4-(methylamino)-1-[6-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]-3-pyridinyl]piperidin-2-one;(4S)-4-(methylamino)-1-[6-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]-3-pyridinyl]piperidin-2-one;(4R)-4-(methylamino)-1-[6-[[4-(3-propan-2-ylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]methyl]-3-pyridinyl]piperidin-2-one;methyl thiohypofluorite
CID 167657680

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one?
The IUPAC name of 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one (CID 155282131) is 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one.
What is the SMILES notation for 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one?
The canonical SMILES for 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one is CC1(N)CCN(c2ccc(Nc3nccc(-c4ccn5ncc(C(C)(C)C)c5c4)n3)nc2)C(=O)C1.
What is the InChIKey of 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one?
The InChIKey is GRGYZHMEKLHYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N8O/c1-25(2,3)19-16-30-34-11-8-17(13-21(19)34)20-7-10-28-24(31-20)32-22-6-5-18(15-29-22)33-12-9-26(4,27)14-23(33)35/h5-8,10-11,13,15-16H,9,12,14,27H2,1-4H3,(H,28,29,31,32).
What are the key properties of 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one?
4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one has a molecular weight of 470.58 g/mol, XLogP of 4.07, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-[6-[[4-(3-tert-butylpyrazolo[1,5-a]pyridin-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-4-methylpiperidin-2-one is sourced from PubChem (CID 155282131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).