N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine

C15H25N5 — CID 46996898

IUPACN-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine
SMILESCc1nn(C)c(C)c1CN(Cc1nc[nH]c1C)C(C)C
InChIInChI=1S/C15H25N5/c1-10(2)20(8-15-12(4)16-9-17-15)7-14-11(3)18-19(6)13(14)5/h9-10H,7-8H2,1-6H3,(H,16,17)
InChIKeyRJCFUCJAJDPQOY-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.48
Rot. Bonds5

About N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine

N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine (PubChem CID 46996898) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine
PubChem CID46996898
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC NameN-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine
SMILESCc1nn(C)c(C)c1CN(Cc1nc[nH]c1C)C(C)C
InChIInChI=1S/C15H25N5/c1-10(2)20(8-15-12(4)16-9-17-15)7-14-11(3)18-19(6)13(14)5/h9-10H,7-8H2,1-6H3,(H,16,17)
InChIKeyRJCFUCJAJDPQOY-UHFFFAOYSA-N
XLogP2.48
TPSA49.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine?
The IUPAC name of N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine (CID 46996898) is N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine.
What is the SMILES notation for N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine?
The canonical SMILES for N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine is Cc1nn(C)c(C)c1CN(Cc1nc[nH]c1C)C(C)C.
What is the InChIKey of N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine?
The InChIKey is RJCFUCJAJDPQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-10(2)20(8-15-12(4)16-9-17-15)7-14-11(3)18-19(6)13(14)5/h9-10H,7-8H2,1-6H3,(H,16,17).
What are the key properties of N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine?
N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine has a molecular weight of 275.40 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1H-imidazol-4-yl)methyl]-N-[(1,3,5-trimethylpyrazol-4-yl)methyl]propan-2-amine is sourced from PubChem (CID 46996898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).