(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone

C9H14N4O2 — CID 64524794

IUPAC(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)c2cc(N)n[nH]2)CCO1
InChIInChI=1S/C9H14N4O2/c1-6-5-13(2-3-15-6)9(14)7-4-8(10)12-11-7/h4,6H,2-3,5H2,1H3,(H3,10,11,12)
InChIKeySYOGRNGNGIZFHL-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.15
Rot. Bonds1

About (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone

(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone (PubChem CID 64524794) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone
PubChem CID64524794
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone
SMILESCC1CN(C(=O)c2cc(N)n[nH]2)CCO1
InChIInChI=1S/C9H14N4O2/c1-6-5-13(2-3-15-6)9(14)7-4-8(10)12-11-7/h4,6H,2-3,5H2,1H3,(H3,10,11,12)
InChIKeySYOGRNGNGIZFHL-UHFFFAOYSA-N
XLogP-0.15
TPSA84.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone?
The IUPAC name of (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone (CID 64524794) is (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone.
What is the SMILES notation for (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone?
The canonical SMILES for (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone is CC1CN(C(=O)c2cc(N)n[nH]2)CCO1.
What is the InChIKey of (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone?
The InChIKey is SYOGRNGNGIZFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-6-5-13(2-3-15-6)9(14)7-4-8(10)12-11-7/h4,6H,2-3,5H2,1H3,(H3,10,11,12).
What are the key properties of (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone?
(3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone has a molecular weight of 210.24 g/mol, XLogP of -0.15, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-1H-pyrazol-5-yl)-(2-methylmorpholin-4-yl)methanone is sourced from PubChem (CID 64524794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).