4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide

C19H22N6O2 — CID 21070878

IUPAC4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide
SMILESCNc1nccn2c(-c3ccc(NC(=O)N4CCC(O)CC4)cc3)cnc12
InChIInChI=1S/C19H22N6O2/c1-20-17-18-22-12-16(25(18)11-8-21-17)13-2-4-14(5-3-13)23-19(27)24-9-6-15(26)7-10-24/h2-5,8,11-12,15,26H,6-7,9-10H2,1H3,(H,20,21)(H,23,27)
InChIKeyVTDFJFGUZWOOMG-UHFFFAOYSA-N
MW366.43 g/mol
LogP2.43
Rot. Bonds3

About 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide

4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide (PubChem CID 21070878) has the molecular formula C19H22N6O2 and a molecular weight of 366.43 g/mol. Its IUPAC name is 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide
PubChem CID21070878
Molecular FormulaC19H22N6O2
Molecular Weight366.43 g/mol
Exact Mass366.18
IUPAC Name4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide
SMILESCNc1nccn2c(-c3ccc(NC(=O)N4CCC(O)CC4)cc3)cnc12
InChIInChI=1S/C19H22N6O2/c1-20-17-18-22-12-16(25(18)11-8-21-17)13-2-4-14(5-3-13)23-19(27)24-9-6-15(26)7-10-24/h2-5,8,11-12,15,26H,6-7,9-10H2,1H3,(H,20,21)(H,23,27)
InChIKeyVTDFJFGUZWOOMG-UHFFFAOYSA-N
XLogP2.43
TPSA94.79 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.43
LogP ≤ 52.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

[4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylphenyl]-[4-(methylamino)piperidin-1-yl]methanone
CID 150787408
4-N-[3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]-1-N-methylbenzene-1,4-diamine
CID 166890004
4-[(3-thiophen-3-ylimidazo[1,2-a]pyrazin-8-yl)amino]cyclohexan-1-ol
CID 126472088
N-[4-[[3-[3-fluoro-4-(methylamino)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]phenyl]-2-hydroxyacetamide
CID 162384162
[5-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]thiophen-2-yl]-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 11327352
3-hydroxy-N-[4-(1,3-thiazol-2-yl)phenyl]pyrrolidine-1-carboxamide
CID 75502898
[4-[[3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylphenyl]-(4-methylpiperazin-1-yl)methanone
CID 154943656
4-methyl-N-(6-methyl-3-pyridinyl)piperidine-1-carboxamide
CID 115742442
4-hydroxy-N-[3-[(4-hydroxypiperidine-1-carbonyl)amino]-4-methylphenyl]piperidine-1-carboxamide
CID 41296153
4-[[3-[4-(difluoromethoxy)phenyl]imidazo[1,2-a]pyrazin-8-yl]amino]-N-[2-[2-(4-hydroxypiperidin-1-yl)ethoxy]ethyl]-2-methylbenzamide
CID 154943771
5-[8-(methylamino)imidazo[1,2-a]pyrazin-5-yl]-2,3-dihydroinden-1-one
CID 59496149
3-[[1-[4-[[3-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-8-yl]amino]-2-methylbenzoyl]piperidin-4-yl]methylamino]propanenitrile
CID 154943418

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide?
The IUPAC name of 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide (CID 21070878) is 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide?
The canonical SMILES for 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide is CNc1nccn2c(-c3ccc(NC(=O)N4CCC(O)CC4)cc3)cnc12.
What is the InChIKey of 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide?
The InChIKey is VTDFJFGUZWOOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O2/c1-20-17-18-22-12-16(25(18)11-8-21-17)13-2-4-14(5-3-13)23-19(27)24-9-6-15(26)7-10-24/h2-5,8,11-12,15,26H,6-7,9-10H2,1H3,(H,20,21)(H,23,27).
What are the key properties of 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide?
4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide has a molecular weight of 366.43 g/mol, XLogP of 2.43, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[4-[8-(methylamino)imidazo[1,2-a]pyrazin-3-yl]phenyl]piperidine-1-carboxamide is sourced from PubChem (CID 21070878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).