(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone

C9H14N4O2 — CID 739809

IUPAC(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone
SMILESCn1ncc(N)c1C(=O)N1CCOCC1
InChIInChI=1S/C9H14N4O2/c1-12-8(7(10)6-11-12)9(14)13-2-4-15-5-3-13/h6H,2-5,10H2,1H3
InChIKeyQMJQPCQHYNXXGD-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.53
Rot. Bonds1

About (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone

(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone (PubChem CID 739809) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone.

Molecular Properties

Compound Name(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone
PubChem CID739809
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone
SMILESCn1ncc(N)c1C(=O)N1CCOCC1
InChIInChI=1S/C9H14N4O2/c1-12-8(7(10)6-11-12)9(14)13-2-4-15-5-3-13/h6H,2-5,10H2,1H3
InChIKeyQMJQPCQHYNXXGD-UHFFFAOYSA-N
XLogP-0.53
TPSA73.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone?
The IUPAC name of (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone (CID 739809) is (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone.
What is the SMILES notation for (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone?
The canonical SMILES for (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone is Cn1ncc(N)c1C(=O)N1CCOCC1.
What is the InChIKey of (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone?
The InChIKey is QMJQPCQHYNXXGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-12-8(7(10)6-11-12)9(14)13-2-4-15-5-3-13/h6H,2-5,10H2,1H3.
What are the key properties of (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone?
(4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone has a molecular weight of 210.24 g/mol, XLogP of -0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-amino-1-methylpyrazol-5-yl)-morpholin-4-ylmethanone is sourced from PubChem (CID 739809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).