[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone

C10H16N4O2 — CID 81485136

IUPAC[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
SMILESCC(N)C1CN(C(=O)c2ccn[nH]2)CCO1
InChIInChI=1S/C10H16N4O2/c1-7(11)9-6-14(4-5-16-9)10(15)8-2-3-12-13-8/h2-3,7,9H,4-6,11H2,1H3,(H,12,13)
InChIKeyVGYAQCCCTXIZLW-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.40
Rot. Bonds2

About [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone

[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone (PubChem CID 81485136) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone.

Molecular Properties

Compound Name[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
PubChem CID81485136
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
SMILESCC(N)C1CN(C(=O)c2ccn[nH]2)CCO1
InChIInChI=1S/C10H16N4O2/c1-7(11)9-6-14(4-5-16-9)10(15)8-2-3-12-13-8/h2-3,7,9H,4-6,11H2,1H3,(H,12,13)
InChIKeyVGYAQCCCTXIZLW-UHFFFAOYSA-N
XLogP-0.40
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(1-aminoethyl)morpholin-4-yl]-pyridin-4-ylmethanone
CID 81484704
[2-(1-aminoethyl)morpholin-4-yl]-(2-methylpyrazol-3-yl)methanone
CID 81485227
[2-(hydroxymethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 81208376
4-[2-(1-aminoethyl)morpholine-4-carbonyl]-1,3-dihydroimidazol-2-one
CID 113285001
[2-(chloromethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 81209890
6-[2-(1-aminoethyl)morpholine-4-carbonyl]-1H-pyrimidine-2,4-dione
CID 115315193
[2-(1-aminoethyl)morpholin-4-yl]-(4-iodophenyl)methanone
CID 81484348
[2-(1-aminoethyl)morpholin-4-yl]-(1-methylimidazol-2-yl)methanone
CID 113284997
[2-(1-aminoethyl)morpholin-4-yl]-(5-propan-2-yl-1H-1,2,4-triazol-3-yl)methanone
CID 115315127
[(2S)-2-(2-methylpyrimidin-4-yl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone
CID 124993182
[2-(1-aminoethyl)morpholin-4-yl]-(4-methoxyphenyl)methanone
CID 81484356
[2-(1-aminoethyl)morpholin-4-yl]-(1-methylpyrazol-4-yl)methanone
CID 81424177

Frequently Asked Questions

What is the IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone?
The IUPAC name of [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone (CID 81485136) is [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone.
What is the SMILES notation for [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone?
The canonical SMILES for [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone is CC(N)C1CN(C(=O)c2ccn[nH]2)CCO1.
What is the InChIKey of [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone?
The InChIKey is VGYAQCCCTXIZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-7(11)9-6-14(4-5-16-9)10(15)8-2-3-12-13-8/h2-3,7,9H,4-6,11H2,1H3,(H,12,13).
What are the key properties of [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone?
[2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone has a molecular weight of 224.26 g/mol, XLogP of -0.40, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-aminoethyl)morpholin-4-yl]-(1H-pyrazol-5-yl)methanone is sourced from PubChem (CID 81485136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).