1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide

C15H18BrN3 — CID 166193259

IUPAC1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
SMILESBr.CN1CCN=C1NCc1ccc2ccccc2c1
InChIInChI=1S/C15H17N3.BrH/c1-18-9-8-16-15(18)17-11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11H2,1H3,(H,16,17);1H
InChIKeySTUUKWUSBOQSLM-UHFFFAOYSA-N
MW320.23 g/mol
LogP2.81
Rot. Bonds2

About 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide

1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide (PubChem CID 166193259) has the molecular formula C15H18BrN3 and a molecular weight of 320.23 g/mol. Its IUPAC name is 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide.

Molecular Properties

Compound Name1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
PubChem CID166193259
Molecular FormulaC15H18BrN3
Molecular Weight320.23 g/mol
Exact Mass319.07
IUPAC Name1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide
SMILESBr.CN1CCN=C1NCc1ccc2ccccc2c1
InChIInChI=1S/C15H17N3.BrH/c1-18-9-8-16-15(18)17-11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11H2,1H3,(H,16,17);1H
InChIKeySTUUKWUSBOQSLM-UHFFFAOYSA-N
XLogP2.81
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.23
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxyethyl)-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 166367127
1-benzyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 166367101
1-(cyclopropylmethyl)-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydroiodide
CID 166367165
1-methyl-N-[(4-propan-2-ylphenyl)methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969753
1-methyl-N-[(4-phenylmethoxyphenyl)methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969601
1,5,5-trimethyl-N-(naphthalen-2-ylmethyl)-4H-imidazol-2-amine;hydroiodide
CID 166367204
1-methyl-N-[[3-(methylsulfanylmethyl)phenyl]methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120972308
1-methyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-4,5-dihydroimidazol-2-amine
CID 120969271
N-[(4-ethoxyphenyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120969673
N-[(3-fluoro-4-methoxyphenyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 120970093
N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 120969223
1-methyl-N-[(6-methyl-3-pyridinyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120969999

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The IUPAC name of 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide (CID 166193259) is 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide.
What is the SMILES notation for 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The canonical SMILES for 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide is Br.CN1CCN=C1NCc1ccc2ccccc2c1.
What is the InChIKey of 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
The InChIKey is STUUKWUSBOQSLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3.BrH/c1-18-9-8-16-15(18)17-11-12-6-7-13-4-2-3-5-14(13)10-12;/h2-7,10H,8-9,11H2,1H3,(H,16,17);1H.
What are the key properties of 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide?
1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide has a molecular weight of 320.23 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(naphthalen-2-ylmethyl)-4,5-dihydroimidazol-2-amine;hydrobromide is sourced from PubChem (CID 166193259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).