1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone

C13H22N4O2 — CID 95283963

IUPAC1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone
SMILESC[C@@H]1CN(C(=O)CN[C@@H](C)Cn2cccn2)CCO1
InChIInChI=1S/C13H22N4O2/c1-11(9-17-5-3-4-15-17)14-8-13(18)16-6-7-19-12(2)10-16/h3-5,11-12,14H,6-10H2,1-2H3/t11-,12+/m0/s1
InChIKeyISDZRYHCUOLHBN-NWDGAFQWSA-N
MW266.34 g/mol
LogP0.11
Rot. Bonds5

About 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone

1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone (PubChem CID 95283963) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone.

Molecular Properties

Compound Name1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone
PubChem CID95283963
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone
SMILESC[C@@H]1CN(C(=O)CN[C@@H](C)Cn2cccn2)CCO1
InChIInChI=1S/C13H22N4O2/c1-11(9-17-5-3-4-15-17)14-8-13(18)16-6-7-19-12(2)10-16/h3-5,11-12,14H,6-10H2,1-2H3/t11-,12+/m0/s1
InChIKeyISDZRYHCUOLHBN-NWDGAFQWSA-N
XLogP0.11
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone with MolForge

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Related Compounds

3-methyl-N-(1-pyrazol-1-ylpropan-2-yl)piperidine-1-carboxamide
CID 115583842
N-carbamoyl-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 61462815
(2R)-1-morpholin-4-yl-2-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]propan-1-one
CID 94159983
N-cyclopentyl-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 54951287
1-[2-(1-aminoethyl)morpholin-4-yl]-2-pyrazol-1-ylethanone
CID 81483915
N-cycloheptyl-2-(1-pyrazol-1-ylpropan-2-ylamino)acetamide
CID 62573457
(2R)-2-(4-fluorophenyl)-N-[(2R)-1-pyrazol-1-ylpropan-2-yl]morpholine-4-carboxamide
CID 94031044
1-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-[[(2S)-1-(4-methylpyrazol-1-yl)propan-2-yl]amino]ethanone
CID 100841147
(2S)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-3-[[(2R)-1-pyrazol-1-ylpropan-2-yl]amino]propan-2-ol
CID 98758880
1-[(2R)-2-methylmorpholin-4-yl]-2-[(1-phenylpyrazol-3-yl)amino]ethanone
CID 95579451
2-methyl-3-(1-pyrazol-1-ylpropan-2-ylamino)propanoic acid
CID 61462644
N-ethyl-1-pyrazol-1-ylpropan-2-amine
CID 43435880

Frequently Asked Questions

What is the IUPAC name of 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone?
The IUPAC name of 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone (CID 95283963) is 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone.
What is the SMILES notation for 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone?
The canonical SMILES for 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone is C[C@@H]1CN(C(=O)CN[C@@H](C)Cn2cccn2)CCO1.
What is the InChIKey of 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone?
The InChIKey is ISDZRYHCUOLHBN-NWDGAFQWSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-11(9-17-5-3-4-15-17)14-8-13(18)16-6-7-19-12(2)10-16/h3-5,11-12,14H,6-10H2,1-2H3/t11-,12+/m0/s1.
What are the key properties of 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone?
1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone has a molecular weight of 266.34 g/mol, XLogP of 0.11, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2R)-2-methylmorpholin-4-yl]-2-[[(2S)-1-pyrazol-1-ylpropan-2-yl]amino]ethanone is sourced from PubChem (CID 95283963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).