N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine

C17H17N3 — CID 42778544

IUPACN-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine
SMILESc1ccc(-c2ccccc2CNCc2cnc[nH]2)cc1
InChIInChI=1S/C17H17N3/c1-2-6-14(7-3-1)17-9-5-4-8-15(17)10-18-11-16-12-19-13-20-16/h1-9,12-13,18H,10-11H2,(H,19,20)
InChIKeyRMEYXPTUSRMFJA-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.37
Rot. Bonds5

About N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine

N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine (PubChem CID 42778544) has the molecular formula C17H17N3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine.

Molecular Properties

Compound NameN-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine
PubChem CID42778544
Molecular FormulaC17H17N3
Molecular Weight263.34 g/mol
Exact Mass263.14
IUPAC NameN-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine
SMILESc1ccc(-c2ccccc2CNCc2cnc[nH]2)cc1
InChIInChI=1S/C17H17N3/c1-2-6-14(7-3-1)17-9-5-4-8-15(17)10-18-11-16-12-19-13-20-16/h1-9,12-13,18H,10-11H2,(H,19,20)
InChIKeyRMEYXPTUSRMFJA-UHFFFAOYSA-N
XLogP3.37
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chlorophenyl)-N-(1H-imidazol-5-ylmethyl)ethanamine;hydrochloride
CID 115607686
1-(2-ethoxyphenyl)-N-(1H-imidazol-5-ylmethyl)methanamine
CID 63000716
N-(1H-imidazol-5-ylmethyl)-1-(2-methoxy-3-pyridinyl)methanamine
CID 62763558
4-[2-(1H-imidazol-5-ylmethyl)phenyl]benzonitrile
CID 59464397
2-[(dimethylamino)methyl]-N-(1H-imidazol-5-ylmethyl)aniline
CID 62762471
N-(1H-imidazol-5-ylmethyl)-1-(2,3,4-trimethoxyphenyl)methanamine
CID 63002008
N-[(2-phenylphenyl)methyl]prop-2-en-1-amine
CID 90242469
N-(1H-imidazol-5-ylmethyl)-1-(3-methylphenyl)methanamine
CID 62762804
N-(1H-imidazol-5-ylmethyl)-1-(6-methyl-2-pyridinyl)methanamine
CID 62761606
N-(1H-imidazol-5-ylmethyl)-1-(1H-pyrrol-3-yl)methanamine
CID 66407683
4-[1-(4-amino-3-phenylphenyl)-2-(1H-imidazol-5-yl)ethyl]-2-phenylaniline
CID 146643118
methane;N'-[(2-phenylphenyl)methyl]-N-[3-[(2-phenylphenyl)methylamino]propyl]butane-1,4-diamine;trihydrobromide
CID 157433735

Frequently Asked Questions

What is the IUPAC name of N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine?
The IUPAC name of N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine (CID 42778544) is N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine.
What is the SMILES notation for N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine?
The canonical SMILES for N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine is c1ccc(-c2ccccc2CNCc2cnc[nH]2)cc1.
What is the InChIKey of N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine?
The InChIKey is RMEYXPTUSRMFJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-2-6-14(7-3-1)17-9-5-4-8-15(17)10-18-11-16-12-19-13-20-16/h1-9,12-13,18H,10-11H2,(H,19,20).
What are the key properties of N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine?
N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine has a molecular weight of 263.34 g/mol, XLogP of 3.37, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-imidazol-5-ylmethyl)-1-(2-phenylphenyl)methanamine is sourced from PubChem (CID 42778544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).