1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one

C14H21N3O2 — CID 81402403

IUPAC1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one
SMILESCC(N[C@H](C)c1ccccn1)C(=O)N1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-11(13-5-3-4-6-15-13)16-12(2)14(18)17-7-9-19-10-8-17/h3-6,11-12,16H,7-10H2,1-2H3/t11-,12?/m1/s1
InChIKeyZNSOLAQVROCUQF-JHJMLUEUSA-N
MW263.34 g/mol
LogP0.98
Rot. Bonds4

About 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one

1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one (PubChem CID 81402403) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one.

Molecular Properties

Compound Name1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one
PubChem CID81402403
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one
SMILESCC(N[C@H](C)c1ccccn1)C(=O)N1CCOCC1
InChIInChI=1S/C14H21N3O2/c1-11(13-5-3-4-6-15-13)16-12(2)14(18)17-7-9-19-10-8-17/h3-6,11-12,16H,7-10H2,1-2H3/t11-,12?/m1/s1
InChIKeyZNSOLAQVROCUQF-JHJMLUEUSA-N
XLogP0.98
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one?
The IUPAC name of 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one (CID 81402403) is 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one.
What is the SMILES notation for 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one?
The canonical SMILES for 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one is CC(N[C@H](C)c1ccccn1)C(=O)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one?
The InChIKey is ZNSOLAQVROCUQF-JHJMLUEUSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-11(13-5-3-4-6-15-13)16-12(2)14(18)17-7-9-19-10-8-17/h3-6,11-12,16H,7-10H2,1-2H3/t11-,12?/m1/s1.
What are the key properties of 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one?
1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one has a molecular weight of 263.34 g/mol, XLogP of 0.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-2-[[(1R)-1-pyridin-2-ylethyl]amino]propan-1-one is sourced from PubChem (CID 81402403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).