N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine

C17H19N3 — CID 116877341

IUPACN-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine
SMILESCCNCc1ncc(-c2ccc3cc(C)ccc3c2)[nH]1
InChIInChI=1S/C17H19N3/c1-3-18-11-17-19-10-16(20-17)15-7-6-13-8-12(2)4-5-14(13)9-15/h4-10,18H,3,11H2,1-2H3,(H,19,20)
InChIKeyOLMSPCLDQUOSLH-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.65
Rot. Bonds4

About N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine

N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine (PubChem CID 116877341) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine
PubChem CID116877341
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine
SMILESCCNCc1ncc(-c2ccc3cc(C)ccc3c2)[nH]1
InChIInChI=1S/C17H19N3/c1-3-18-11-17-19-10-16(20-17)15-7-6-13-8-12(2)4-5-14(13)9-15/h4-10,18H,3,11H2,1-2H3,(H,19,20)
InChIKeyOLMSPCLDQUOSLH-UHFFFAOYSA-N
XLogP3.65
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methanethiol
CID 116879256
2-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]acetonitrile
CID 116880093
2-chloro-5-(6-methylnaphthalen-2-yl)-1H-imidazole
CID 116884464
2-methyl-N-[(5-naphthalen-2-yl-1H-imidazol-2-yl)methyl]propan-1-amine
CID 63954065
N-methyl-5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-amine
CID 116879529
N-[[5-(4-butan-2-ylphenyl)-1H-imidazol-2-yl]methyl]ethanamine
CID 116877297
2-methoxy-N-[(5-naphthalen-2-yl-1H-imidazol-2-yl)methyl]ethanamine
CID 63954680
5-(6-methylnaphthalen-2-yl)-1H-imidazole-2-carboxylic acid
CID 116878561
1-[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]ethanamine
CID 116876598
1-[5-(3,4-dimethylphenyl)-1H-imidazol-2-yl]-N-methylmethanamine
CID 43651401
1-[5-(4-methoxyphenyl)-1H-imidazol-2-yl]-N-methylmethanamine;dihydrochloride
CID 72716184
N-[[5-[2-[4-[2-(propylaminomethyl)-1H-imidazol-5-yl]phenyl]ethyl]-1H-imidazol-2-yl]methyl]propan-1-amine
CID 123743795

Frequently Asked Questions

What is the IUPAC name of N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine?
The IUPAC name of N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine (CID 116877341) is N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine.
What is the SMILES notation for N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine?
The canonical SMILES for N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine is CCNCc1ncc(-c2ccc3cc(C)ccc3c2)[nH]1.
What is the InChIKey of N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine?
The InChIKey is OLMSPCLDQUOSLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-3-18-11-17-19-10-16(20-17)15-7-6-13-8-12(2)4-5-14(13)9-15/h4-10,18H,3,11H2,1-2H3,(H,19,20).
What are the key properties of N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine?
N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine has a molecular weight of 265.36 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(6-methylnaphthalen-2-yl)-1H-imidazol-2-yl]methyl]ethanamine is sourced from PubChem (CID 116877341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).