N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine

C17H19N3 — CID 79985728

IUPACN-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine
SMILESCNCCc1cn(Cc2cccc3ccccc23)cn1
InChIInChI=1S/C17H19N3/c1-18-10-9-16-12-20(13-19-16)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-8,12-13,18H,9-11H2,1H3
InChIKeySVPDIYFGJSKRKV-UHFFFAOYSA-N
MW265.36 g/mol
LogP2.85
Rot. Bonds5

About N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine

N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine (PubChem CID 79985728) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine
PubChem CID79985728
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine
SMILESCNCCc1cn(Cc2cccc3ccccc23)cn1
InChIInChI=1S/C17H19N3/c1-18-10-9-16-12-20(13-19-16)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-8,12-13,18H,9-11H2,1H3
InChIKeySVPDIYFGJSKRKV-UHFFFAOYSA-N
XLogP2.85
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[1-(quinolin-4-ylmethyl)imidazol-4-yl]ethanamine
CID 79985482
2-[1-[(1-ethylindazol-3-yl)methyl]imidazol-4-yl]-N-methylethanamine
CID 79972718
3-[[4-[2-(methylamino)ethyl]imidazol-1-yl]methyl]pyridine-2-carbonitrile
CID 79985574
N-methyl-2-[1-[(4-methylphenyl)methyl]imidazol-4-yl]ethanamine
CID 79985488
N-methyl-2-[1-[[4-(trifluoromethyl)phenyl]methyl]imidazol-4-yl]ethanamine
CID 79985317
acetaldehyde;N-methyl-2-naphthalen-1-ylethanamine
CID 142942330
N-methyl-2-[1-(3-methylbutyl)imidazol-4-yl]ethanamine
CID 79985899
N-methyl-2-[1-(2-pyridin-4-ylethyl)imidazol-4-yl]ethanamine
CID 79985908
N-methyl-1-naphthalen-1-ylmethanamine
CID 69403999
4-[4-[2-(methylamino)ethyl]imidazol-1-yl]butan-1-ol
CID 79985168
2-[1-[(5-bromo-3-pyridinyl)methyl]imidazol-4-yl]-N-methylethanamine
CID 113455792
N-[2-(1-benzylimidazol-4-yl)ethyl]propan-1-amine
CID 79985350

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine?
The IUPAC name of N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine (CID 79985728) is N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine?
The canonical SMILES for N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine is CNCCc1cn(Cc2cccc3ccccc23)cn1.
What is the InChIKey of N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine?
The InChIKey is SVPDIYFGJSKRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-18-10-9-16-12-20(13-19-16)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-8,12-13,18H,9-11H2,1H3.
What are the key properties of N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine?
N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine has a molecular weight of 265.36 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[1-(naphthalen-1-ylmethyl)imidazol-4-yl]ethanamine is sourced from PubChem (CID 79985728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).