2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine

C17H23N7O — CID 172899981

IUPAC2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine
SMILESc1cnc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)cn1
InChIInChI=1S/C17H23N7O/c1-2-14(13-24(7-1)16-12-18-5-6-19-16)21-15-3-4-20-17(22-15)23-8-10-25-11-9-23/h3-6,12,14H,1-2,7-11,13H2,(H,20,21,22)
InChIKeyVPDYRRLGJALVAC-UHFFFAOYSA-N
MW341.42 g/mol
LogP1.18
Rot. Bonds4

About 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine

2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine (PubChem CID 172899981) has the molecular formula C17H23N7O and a molecular weight of 341.42 g/mol. Its IUPAC name is 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine
PubChem CID172899981
Molecular FormulaC17H23N7O
Molecular Weight341.42 g/mol
Exact Mass341.20
IUPAC Name2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine
SMILESc1cnc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)cn1
InChIInChI=1S/C17H23N7O/c1-2-14(13-24(7-1)16-12-18-5-6-19-16)21-15-3-4-20-17(22-15)23-8-10-25-11-9-23/h3-6,12,14H,1-2,7-11,13H2,(H,20,21,22)
InChIKeyVPDYRRLGJALVAC-UHFFFAOYSA-N
XLogP1.18
TPSA79.30 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-[1-(5-bromopyrimidin-2-yl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 172900765
N-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 175649260
2-morpholin-4-yl-N-[1-[5-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]pyrimidin-4-amine
CID 172902099
2-morpholin-4-yl-N-[1-(2-propan-2-ylpyrimidin-4-yl)piperidin-3-yl]pyrimidin-4-amine
CID 172900711
2-morpholin-4-yl-N-[1-[6-(trifluoromethyl)-2-pyridinyl]piperidin-3-yl]pyrimidin-4-amine
CID 172902096
N-(1-imidazo[1,2-a]pyrazin-8-ylpiperidin-3-yl)-2-morpholin-4-ylpyrimidin-4-amine
CID 172904241
N-[1-(5-fluoropyrimidin-4-yl)pyrrolidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 175648592
2-morpholin-4-yl-N-(1-pyrazolo[1,5-a]pyrimidin-5-ylpyrrolidin-3-yl)pyrimidin-4-amine
CID 175650740
2-morpholin-4-yl-N-[1-(pyridin-2-ylmethyl)piperidin-3-yl]pyrimidin-4-amine
CID 175649604
N-[1-(4,6-dimethoxypyrimidin-2-yl)pyrrolidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 172901782
N-[1-[(5-bromofuran-2-yl)methyl]piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 172903179
N-[1-(6-methyl-5H-pyrrolo[3,2-d]pyrimidin-4-yl)piperidin-3-yl]-2-morpholin-4-ylpyrimidin-4-amine
CID 175651069

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine?
The IUPAC name of 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine (CID 172899981) is 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine.
What is the SMILES notation for 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine?
The canonical SMILES for 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine is c1cnc(N2CCCC(Nc3ccnc(N4CCOCC4)n3)C2)cn1.
What is the InChIKey of 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine?
The InChIKey is VPDYRRLGJALVAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N7O/c1-2-14(13-24(7-1)16-12-18-5-6-19-16)21-15-3-4-20-17(22-15)23-8-10-25-11-9-23/h3-6,12,14H,1-2,7-11,13H2,(H,20,21,22).
What are the key properties of 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine?
2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine has a molecular weight of 341.42 g/mol, XLogP of 1.18, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-N-(1-pyrazin-2-ylpiperidin-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 172899981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).