(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine

C11H13N3 — CID 124512474

IUPAC(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine
SMILESCN[C@H](c1ccccc1)c1ncc[nH]1
InChIInChI=1S/C11H13N3/c1-12-10(11-13-7-8-14-11)9-5-3-2-4-6-9/h2-8,10,12H,1H3,(H,13,14)/t10-/m1/s1
InChIKeyBMWHWEYKWBMGOV-SNVBAGLBSA-N
MW187.25 g/mol
LogP1.72
Rot. Bonds3

About (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine

(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine (PubChem CID 124512474) has the molecular formula C11H13N3 and a molecular weight of 187.25 g/mol. Its IUPAC name is (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine.

Molecular Properties

Compound Name(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine
PubChem CID124512474
Molecular FormulaC11H13N3
Molecular Weight187.25 g/mol
Exact Mass187.11
IUPAC Name(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine
SMILESCN[C@H](c1ccccc1)c1ncc[nH]1
InChIInChI=1S/C11H13N3/c1-12-10(11-13-7-8-14-11)9-5-3-2-4-6-9/h2-8,10,12H,1H3,(H,13,14)/t10-/m1/s1
InChIKeyBMWHWEYKWBMGOV-SNVBAGLBSA-N
XLogP1.72
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.25
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine?
The IUPAC name of (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine (CID 124512474) is (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine.
What is the SMILES notation for (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine?
The canonical SMILES for (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine is CN[C@H](c1ccccc1)c1ncc[nH]1.
What is the InChIKey of (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine?
The InChIKey is BMWHWEYKWBMGOV-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13N3/c1-12-10(11-13-7-8-14-11)9-5-3-2-4-6-9/h2-8,10,12H,1H3,(H,13,14)/t10-/m1/s1.
What are the key properties of (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine?
(1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine has a molecular weight of 187.25 g/mol, XLogP of 1.72, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(1H-imidazol-2-yl)-N-methyl-1-phenylmethanamine is sourced from PubChem (CID 124512474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).