N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine

C12H20N4O — CID 164629720

IUPACN-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine
SMILESC[C@@H](CN(C)c1cnccn1)N1CCOCC1
InChIInChI=1S/C12H20N4O/c1-11(16-5-7-17-8-6-16)10-15(2)12-9-13-3-4-14-12/h3-4,9,11H,5-8,10H2,1-2H3/t11-/m0/s1
InChIKeyJXKXIHYBFZTGOZ-NSHDSACASA-N
MW236.32 g/mol
LogP0.63
Rot. Bonds4

About N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine

N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine (PubChem CID 164629720) has the molecular formula C12H20N4O and a molecular weight of 236.32 g/mol. Its IUPAC name is N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine.

Molecular Properties

Compound NameN-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine
PubChem CID164629720
Molecular FormulaC12H20N4O
Molecular Weight236.32 g/mol
Exact Mass236.16
IUPAC NameN-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine
SMILESC[C@@H](CN(C)c1cnccn1)N1CCOCC1
InChIInChI=1S/C12H20N4O/c1-11(16-5-7-17-8-6-16)10-15(2)12-9-13-3-4-14-12/h3-4,9,11H,5-8,10H2,1-2H3/t11-/m0/s1
InChIKeyJXKXIHYBFZTGOZ-NSHDSACASA-N
XLogP0.63
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine?
The IUPAC name of N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine (CID 164629720) is N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine.
What is the SMILES notation for N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine?
The canonical SMILES for N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine is C[C@@H](CN(C)c1cnccn1)N1CCOCC1.
What is the InChIKey of N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine?
The InChIKey is JXKXIHYBFZTGOZ-NSHDSACASA-N. The full InChI is InChI=1S/C12H20N4O/c1-11(16-5-7-17-8-6-16)10-15(2)12-9-13-3-4-14-12/h3-4,9,11H,5-8,10H2,1-2H3/t11-/m0/s1.
What are the key properties of N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine?
N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine has a molecular weight of 236.32 g/mol, XLogP of 0.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(2S)-2-morpholin-4-ylpropyl]pyrazin-2-amine is sourced from PubChem (CID 164629720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).