N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine

C17H19N3 — CID 65172711

IUPACN-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine
SMILESCNCc1cnc(C)n1Cc1cccc2ccccc12
InChIInChI=1S/C17H19N3/c1-13-19-11-16(10-18-2)20(13)12-15-8-5-7-14-6-3-4-9-17(14)15/h3-9,11,18H,10,12H2,1-2H3
InChIKeyJSQSXMKHSYTZBU-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.11
Rot. Bonds4

About N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine

N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine (PubChem CID 65172711) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine
PubChem CID65172711
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine
SMILESCNCc1cnc(C)n1Cc1cccc2ccccc12
InChIInChI=1S/C17H19N3/c1-13-19-11-16(10-18-2)20(13)12-15-8-5-7-14-6-3-4-9-17(14)15/h3-9,11,18H,10,12H2,1-2H3
InChIKeyJSQSXMKHSYTZBU-UHFFFAOYSA-N
XLogP3.11
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-[(2,6-dichlorophenyl)methyl]-2-methylimidazol-4-yl]-N-methylmethanamine
CID 65172920
N-methyl-1-naphthalen-1-ylmethanamine
CID 69403999
1-[3-[(2,5-dichlorophenyl)methyl]-2-methylimidazol-4-yl]-N-methylmethanamine
CID 65316101
1-[3-[(4-bromophenyl)methyl]-2-methylimidazol-4-yl]-N-methylmethanamine
CID 65172660
N-[[3-[(2-bromophenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine
CID 65171768
1-[3-[(3,4-dimethylphenyl)methyl]-2-methylimidazol-4-yl]-N-methylmethanamine
CID 65173081
(4R)-4-[(2,3-dimethylimidazol-4-yl)methylamino]-1-(naphthalen-1-ylmethyl)pyrrolidin-2-one
CID 42593265
2-methoxy-N-[[2-methyl-3-[(2-methylphenyl)methyl]imidazol-4-yl]methyl]ethanamine
CID 65172394
N-[[3-[(2-chloro-3-fluorophenyl)methyl]-2-methylimidazol-4-yl]methyl]-2-methylpropan-2-amine
CID 115984376
N-[[3-[(2,3-dichlorophenyl)methyl]-2-methylimidazol-4-yl]methyl]propan-2-amine
CID 107310259
N-methyl-1-(2-methyl-3-prop-2-ynylimidazol-4-yl)methanamine
CID 65173129
N-methyl-1-(3-methylimidazo[1,5-a]pyridin-5-yl)methanamine
CID 83827498

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine?
The IUPAC name of N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine (CID 65172711) is N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine is CNCc1cnc(C)n1Cc1cccc2ccccc12.
What is the InChIKey of N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine?
The InChIKey is JSQSXMKHSYTZBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-13-19-11-16(10-18-2)20(13)12-15-8-5-7-14-6-3-4-9-17(14)15/h3-9,11,18H,10,12H2,1-2H3.
What are the key properties of N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine?
N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine has a molecular weight of 265.36 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-methyl-3-(naphthalen-1-ylmethyl)imidazol-4-yl]methanamine is sourced from PubChem (CID 65172711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).