1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine

C9H16N4O — CID 79678428

IUPAC1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine
SMILESCn1ncc(CN2CCOCC2)c1N
InChIInChI=1S/C9H16N4O/c1-12-9(10)8(6-11-12)7-13-2-4-14-5-3-13/h6H,2-5,7,10H2,1H3
InChIKeyAZWSLVYASYGYDJ-UHFFFAOYSA-N
MW196.25 g/mol
LogP-0.17
Rot. Bonds2

About 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine

1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine (PubChem CID 79678428) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine
PubChem CID79678428
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine
SMILESCn1ncc(CN2CCOCC2)c1N
InChIInChI=1S/C9H16N4O/c1-12-9(10)8(6-11-12)7-13-2-4-14-5-3-13/h6H,2-5,7,10H2,1H3
InChIKeyAZWSLVYASYGYDJ-UHFFFAOYSA-N
XLogP-0.17
TPSA56.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The IUPAC name of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine (CID 79678428) is 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The canonical SMILES for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine is Cn1ncc(CN2CCOCC2)c1N.
What is the InChIKey of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
The InChIKey is AZWSLVYASYGYDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-12-9(10)8(6-11-12)7-13-2-4-14-5-3-13/h6H,2-5,7,10H2,1H3.
What are the key properties of 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine?
1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine has a molecular weight of 196.25 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(morpholin-4-ylmethyl)pyrazol-5-amine is sourced from PubChem (CID 79678428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).