2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone

C10H16N4O2 — CID 79778249

IUPAC2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone
SMILESCn1cc(NCC(=O)N2CCOCC2)cn1
InChIInChI=1S/C10H16N4O2/c1-13-8-9(6-12-13)11-7-10(15)14-2-4-16-5-3-14/h6,8,11H,2-5,7H2,1H3
InChIKeyNOONIDGCZDYCIQ-UHFFFAOYSA-N
MW224.26 g/mol
LogP-0.31
Rot. Bonds3

About 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone

2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone (PubChem CID 79778249) has the molecular formula C10H16N4O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone
PubChem CID79778249
Molecular FormulaC10H16N4O2
Molecular Weight224.26 g/mol
Exact Mass224.13
IUPAC Name2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone
SMILESCn1cc(NCC(=O)N2CCOCC2)cn1
InChIInChI=1S/C10H16N4O2/c1-13-8-9(6-12-13)11-7-10(15)14-2-4-16-5-3-14/h6,8,11H,2-5,7H2,1H3
InChIKeyNOONIDGCZDYCIQ-UHFFFAOYSA-N
XLogP-0.31
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone (CID 79778249) is 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone is Cn1cc(NCC(=O)N2CCOCC2)cn1.
What is the InChIKey of 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone?
The InChIKey is NOONIDGCZDYCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O2/c1-13-8-9(6-12-13)11-7-10(15)14-2-4-16-5-3-14/h6,8,11H,2-5,7H2,1H3.
What are the key properties of 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone?
2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone has a molecular weight of 224.26 g/mol, XLogP of -0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-methylpyrazol-4-yl)amino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 79778249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).