5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine

C21H31N9O — CID 163621376

IUPAC5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine
SMILESCC(C)([C@H]1CN2C=C(c3cnc(N)nc3)N=C(N3CCOCC3)C2=N1)N1CCNCC1
InChIInChI=1S/C21H31N9O/c1-21(2,30-5-3-23-4-6-30)17-14-29-13-16(15-11-24-20(22)25-12-15)26-18(19(29)27-17)28-7-9-31-10-8-28/h11-13,17,23H,3-10,14H2,1-2H3,(H2,22,24,25)/t17-/m1/s1
InChIKeyHOJYQRRLKJCGNW-QGZVFWFLSA-N
MW425.54 g/mol
LogP-0.13
Rot. Bonds3

About 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine

5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine (PubChem CID 163621376) has the molecular formula C21H31N9O and a molecular weight of 425.54 g/mol. Its IUPAC name is 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine
PubChem CID163621376
Molecular FormulaC21H31N9O
Molecular Weight425.54 g/mol
Exact Mass425.27
IUPAC Name5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine
SMILESCC(C)([C@H]1CN2C=C(c3cnc(N)nc3)N=C(N3CCOCC3)C2=N1)N1CCNCC1
InChIInChI=1S/C21H31N9O/c1-21(2,30-5-3-23-4-6-30)17-14-29-13-16(15-11-24-20(22)25-12-15)26-18(19(29)27-17)28-7-9-31-10-8-28/h11-13,17,23H,3-10,14H2,1-2H3,(H2,22,24,25)/t17-/m1/s1
InChIKeyHOJYQRRLKJCGNW-QGZVFWFLSA-N
XLogP-0.13
TPSA107.50 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.54
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine with MolForge

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Related Compounds

5-ethyl-N-(2-morpholin-4-ylbutyl)pyrimidin-2-amine
CID 72919733
(3S)-N-[(2-morpholin-4-ylpyrimidin-5-yl)methyl]-1-propan-2-ylpyrrolidin-3-amine
CID 95598765
5-[8-[(3R)-3-methylpiperazin-1-yl]-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)-1,2,3,4,5,6-hexahydropurin-2-yl]pyrimidin-2-amine
CID 59333672
5-[6-Morpholin-4-yl-8-piperazin-1-yl-9-(2,2,2-trifluoroethyl)-4,5-dihydropurin-2-yl]pyrimidin-2-amine
CID 117879123
5-[8-[(3R)-3-ethylpiperazin-1-yl]-4-methyl-6-morpholin-4-yl-9-(2,2,2-trifluoroethyl)-5H-purin-2-yl]pyrimidin-2-amine
CID 163780682
N-[5-methyl-2-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-4-yl]-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 117093909
N-(5-methyl-2-morpholin-4-ylpyrimidin-4-yl)-N',N'-di(propan-2-yl)ethane-1,2-diamine
CID 117083189
5-methyl-N-(2-morpholin-4-ylethyl)-2-(4-morpholin-4-ylpiperidin-1-yl)pyrimidin-4-amine
CID 117087353
4-N-[2-[di(propan-2-yl)amino]ethyl]-5-methyl-2-N-(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 117088552
5-methyl-2-N,4-N-bis(2-morpholin-4-ylethyl)pyrimidine-2,4-diamine
CID 117088672
5-methyl-2-(4-morpholin-4-ylpiperidin-1-yl)-N-propylpyrimidin-4-amine
CID 117089252
5-methyl-2-morpholin-4-yl-N-(2-morpholin-4-ylethyl)pyrimidin-4-amine
CID 117092082

Frequently Asked Questions

What is the IUPAC name of 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine?
The IUPAC name of 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine (CID 163621376) is 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine.
What is the SMILES notation for 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine?
The canonical SMILES for 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine is CC(C)([C@H]1CN2C=C(c3cnc(N)nc3)N=C(N3CCOCC3)C2=N1)N1CCNCC1.
What is the InChIKey of 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine?
The InChIKey is HOJYQRRLKJCGNW-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H31N9O/c1-21(2,30-5-3-23-4-6-30)17-14-29-13-16(15-11-24-20(22)25-12-15)26-18(19(29)27-17)28-7-9-31-10-8-28/h11-13,17,23H,3-10,14H2,1-2H3,(H2,22,24,25)/t17-/m1/s1.
What are the key properties of 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine?
5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine has a molecular weight of 425.54 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2R)-8-morpholin-4-yl-2-(2-piperazin-1-ylpropan-2-yl)-2,3-dihydroimidazo[1,2-a]pyrazin-6-yl]pyrimidin-2-amine is sourced from PubChem (CID 163621376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).