N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine

C22H21N5 — CID 155582297

IUPACN-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine
SMILESCc1cccc(-c2nc(CNCc3ccccc3)[nH]c2-c2ccccn2)n1
InChIInChI=1S/C22H21N5/c1-16-8-7-12-19(25-16)22-21(18-11-5-6-13-24-18)26-20(27-22)15-23-14-17-9-3-2-4-10-17/h2-13,23H,14-15H2,1H3,(H,26,27)
InChIKeyFJZIJCWOJGVVRI-UHFFFAOYSA-N
MW355.45 g/mol
LogP4.13
Rot. Bonds6

About N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine

N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine (PubChem CID 155582297) has the molecular formula C22H21N5 and a molecular weight of 355.45 g/mol. Its IUPAC name is N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine.

Molecular Properties

Compound NameN-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine
PubChem CID155582297
Molecular FormulaC22H21N5
Molecular Weight355.45 g/mol
Exact Mass355.18
IUPAC NameN-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine
SMILESCc1cccc(-c2nc(CNCc3ccccc3)[nH]c2-c2ccccn2)n1
InChIInChI=1S/C22H21N5/c1-16-8-7-12-19(25-16)22-21(18-11-5-6-13-24-18)26-20(27-22)15-23-14-17-9-3-2-4-10-17/h2-13,23H,14-15H2,1H3,(H,26,27)
InChIKeyFJZIJCWOJGVVRI-UHFFFAOYSA-N
XLogP4.13
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.45
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine?
The IUPAC name of N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine (CID 155582297) is N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine.
What is the SMILES notation for N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine?
The canonical SMILES for N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine is Cc1cccc(-c2nc(CNCc3ccccc3)[nH]c2-c2ccccn2)n1.
What is the InChIKey of N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine?
The InChIKey is FJZIJCWOJGVVRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N5/c1-16-8-7-12-19(25-16)22-21(18-11-5-6-13-24-18)26-20(27-22)15-23-14-17-9-3-2-4-10-17/h2-13,23H,14-15H2,1H3,(H,26,27).
What are the key properties of N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine?
N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine has a molecular weight of 355.45 g/mol, XLogP of 4.13, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(6-methyl-2-pyridinyl)-5-pyridin-2-yl-1H-imidazol-2-yl]methyl]-1-phenylmethanamine is sourced from PubChem (CID 155582297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).