N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine

C11H17N5 — CID 122166863

IUPACN-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCc1cnn(C)c1CNc1cc(C)n(C)n1
InChIInChI=1S/C11H17N5/c1-8-6-13-16(4)10(8)7-12-11-5-9(2)15(3)14-11/h5-6H,7H2,1-4H3,(H,12,14)
InChIKeyHHHCXDOFJCNVMJ-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.38
Rot. Bonds3

About N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine

N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine (PubChem CID 122166863) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine.

Molecular Properties

Compound NameN-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine
PubChem CID122166863
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine
SMILESCc1cnn(C)c1CNc1cc(C)n(C)n1
InChIInChI=1S/C11H17N5/c1-8-6-13-16(4)10(8)7-12-11-5-9(2)15(3)14-11/h5-6H,7H2,1-4H3,(H,12,14)
InChIKeyHHHCXDOFJCNVMJ-UHFFFAOYSA-N
XLogP1.38
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The IUPAC name of N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine (CID 122166863) is N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine.
What is the SMILES notation for N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The canonical SMILES for N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine is Cc1cnn(C)c1CNc1cc(C)n(C)n1.
What is the InChIKey of N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine?
The InChIKey is HHHCXDOFJCNVMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-8-6-13-16(4)10(8)7-12-11-5-9(2)15(3)14-11/h5-6H,7H2,1-4H3,(H,12,14).
What are the key properties of N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine?
N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine has a molecular weight of 219.29 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1,4-dimethylpyrazol-5-yl)methyl]-1,5-dimethylpyrazol-3-amine is sourced from PubChem (CID 122166863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).