1-methyl-4-nitroso-3-phenylpyrazol-5-amine

C10H10N4O — CID 5325343

IUPAC1-methyl-4-nitroso-3-phenylpyrazol-5-amine
SMILESCn1nc(-c2ccccc2)c(N=O)c1N
InChIInChI=1S/C10H10N4O/c1-14-10(11)9(13-15)8(12-14)7-5-3-2-4-6-7/h2-6H,11H2,1H3
InChIKeyBZCUVYVWVOLQQH-UHFFFAOYSA-N
MW202.22 g/mol
LogP2.07
Rot. Bonds2

About 1-methyl-4-nitroso-3-phenylpyrazol-5-amine

1-methyl-4-nitroso-3-phenylpyrazol-5-amine (PubChem CID 5325343) has the molecular formula C10H10N4O and a molecular weight of 202.22 g/mol. Its IUPAC name is 1-methyl-4-nitroso-3-phenylpyrazol-5-amine.

Molecular Properties

Compound Name1-methyl-4-nitroso-3-phenylpyrazol-5-amine
PubChem CID5325343
Molecular FormulaC10H10N4O
Molecular Weight202.22 g/mol
Exact Mass202.09
IUPAC Name1-methyl-4-nitroso-3-phenylpyrazol-5-amine
SMILESCn1nc(-c2ccccc2)c(N=O)c1N
InChIInChI=1S/C10H10N4O/c1-14-10(11)9(13-15)8(12-14)7-5-3-2-4-6-7/h2-6H,11H2,1H3
InChIKeyBZCUVYVWVOLQQH-UHFFFAOYSA-N
XLogP2.07
TPSA73.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.22
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-nitroso-3-phenylpyrazol-5-amine?
The IUPAC name of 1-methyl-4-nitroso-3-phenylpyrazol-5-amine (CID 5325343) is 1-methyl-4-nitroso-3-phenylpyrazol-5-amine.
What is the SMILES notation for 1-methyl-4-nitroso-3-phenylpyrazol-5-amine?
The canonical SMILES for 1-methyl-4-nitroso-3-phenylpyrazol-5-amine is Cn1nc(-c2ccccc2)c(N=O)c1N.
What is the InChIKey of 1-methyl-4-nitroso-3-phenylpyrazol-5-amine?
The InChIKey is BZCUVYVWVOLQQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O/c1-14-10(11)9(13-15)8(12-14)7-5-3-2-4-6-7/h2-6H,11H2,1H3.
What are the key properties of 1-methyl-4-nitroso-3-phenylpyrazol-5-amine?
1-methyl-4-nitroso-3-phenylpyrazol-5-amine has a molecular weight of 202.22 g/mol, XLogP of 2.07, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-nitroso-3-phenylpyrazol-5-amine is sourced from PubChem (CID 5325343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).