5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine

C15H15N3 — CID 106571383

IUPAC5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine
SMILESCc1cnc(NCc2cccc3ccccc23)[nH]1
InChIInChI=1S/C15H15N3/c1-11-9-16-15(18-11)17-10-13-7-4-6-12-5-2-3-8-14(12)13/h2-9H,10H2,1H3,(H2,16,17,18)
InChIKeyGNILIZPFVYFOSD-UHFFFAOYSA-N
MW237.31 g/mol
LogP3.48
Rot. Bonds3

About 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine

5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine (PubChem CID 106571383) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine
PubChem CID106571383
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine
SMILESCc1cnc(NCc2cccc3ccccc23)[nH]1
InChIInChI=1S/C15H15N3/c1-11-9-16-15(18-11)17-10-13-7-4-6-12-5-2-3-8-14(12)13/h2-9H,10H2,1H3,(H2,16,17,18)
InChIKeyGNILIZPFVYFOSD-UHFFFAOYSA-N
XLogP3.48
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine?
The IUPAC name of 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine (CID 106571383) is 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine.
What is the SMILES notation for 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine?
The canonical SMILES for 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine is Cc1cnc(NCc2cccc3ccccc23)[nH]1.
What is the InChIKey of 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine?
The InChIKey is GNILIZPFVYFOSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-11-9-16-15(18-11)17-10-13-7-4-6-12-5-2-3-8-14(12)13/h2-9H,10H2,1H3,(H2,16,17,18).
What are the key properties of 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine?
5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine has a molecular weight of 237.31 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(naphthalen-1-ylmethyl)-1H-imidazol-2-amine is sourced from PubChem (CID 106571383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).