4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine

C7H10ClN5 — CID 12763845

IUPAC4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine
SMILESCn1ncc(Cl)c1NC1=NCCN1
InChIInChI=1S/C7H10ClN5/c1-13-6(5(8)4-11-13)12-7-9-2-3-10-7/h4H,2-3H2,1H3,(H2,9,10,12)
InChIKeyWUJRXORNIWPSHR-UHFFFAOYSA-N
MW199.65 g/mol
LogP0.44
Rot. Bonds1

About 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine

4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine (PubChem CID 12763845) has the molecular formula C7H10ClN5 and a molecular weight of 199.65 g/mol. Its IUPAC name is 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine.

Molecular Properties

Compound Name4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine
PubChem CID12763845
Molecular FormulaC7H10ClN5
Molecular Weight199.65 g/mol
Exact Mass199.06
IUPAC Name4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine
SMILESCn1ncc(Cl)c1NC1=NCCN1
InChIInChI=1S/C7H10ClN5/c1-13-6(5(8)4-11-13)12-7-9-2-3-10-7/h4H,2-3H2,1H3,(H2,9,10,12)
InChIKeyWUJRXORNIWPSHR-UHFFFAOYSA-N
XLogP0.44
TPSA54.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.65
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine?
The IUPAC name of 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine (CID 12763845) is 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine.
What is the SMILES notation for 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine?
The canonical SMILES for 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine is Cn1ncc(Cl)c1NC1=NCCN1.
What is the InChIKey of 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine?
The InChIKey is WUJRXORNIWPSHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10ClN5/c1-13-6(5(8)4-11-13)12-7-9-2-3-10-7/h4H,2-3H2,1H3,(H2,9,10,12).
What are the key properties of 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine?
4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine has a molecular weight of 199.65 g/mol, XLogP of 0.44, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4,5-dihydro-1H-imidazol-2-yl)-1-methylpyrazol-5-amine is sourced from PubChem (CID 12763845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).