N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine

C15H25N3O — CID 104960865

IUPACN-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1cnc(C)cc1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C15H25N3O/c1-5-16-7-14-8-17-11(2)6-15(14)18-9-12(3)19-13(4)10-18/h6,8,12-13,16H,5,7,9-10H2,1-4H3/t12-,13+
InChIKeySRICDHPJOPTPPD-BETUJISGSA-N
MW263.38 g/mol
LogP2.11
Rot. Bonds4

About N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine

N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine (PubChem CID 104960865) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine
PubChem CID104960865
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine
SMILESCCNCc1cnc(C)cc1N1C[C@@H](C)O[C@@H](C)C1
InChIInChI=1S/C15H25N3O/c1-5-16-7-14-8-17-11(2)6-15(14)18-9-12(3)19-13(4)10-18/h6,8,12-13,16H,5,7,9-10H2,1-4H3/t12-,13+
InChIKeySRICDHPJOPTPPD-BETUJISGSA-N
XLogP2.11
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine (CID 104960865) is N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine is CCNCc1cnc(C)cc1N1C[C@@H](C)O[C@@H](C)C1.
What is the InChIKey of N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine?
The InChIKey is SRICDHPJOPTPPD-BETUJISGSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-16-7-14-8-17-11(2)6-15(14)18-9-12(3)19-13(4)10-18/h6,8,12-13,16H,5,7,9-10H2,1-4H3/t12-,13+.
What are the key properties of N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine?
N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine has a molecular weight of 263.38 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-6-methyl-3-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 104960865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).