(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine

C22H21N5 — CID 166968745

IUPAC(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine
SMILESN/C=C(\N)c1ccnc(-c2cn(CCc3cccc4ccccc34)cn2)c1
InChIInChI=1S/C22H21N5/c23-13-20(24)18-8-10-25-21(12-18)22-14-27(15-26-22)11-9-17-6-3-5-16-4-1-2-7-19(16)17/h1-8,10,12-15H,9,11,23-24H2/b20-13-
InChIKeyHSWBVXJQGQTIJW-MOSHPQCFSA-N
MW355.45 g/mol
LogP3.56
Rot. Bonds5

About (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine

(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine (PubChem CID 166968745) has the molecular formula C22H21N5 and a molecular weight of 355.45 g/mol. Its IUPAC name is (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine
PubChem CID166968745
Molecular FormulaC22H21N5
Molecular Weight355.45 g/mol
Exact Mass355.18
IUPAC Name(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine
SMILESN/C=C(\N)c1ccnc(-c2cn(CCc3cccc4ccccc34)cn2)c1
InChIInChI=1S/C22H21N5/c23-13-20(24)18-8-10-25-21(12-18)22-14-27(15-26-22)11-9-17-6-3-5-16-4-1-2-7-19(16)17/h1-8,10,12-15H,9,11,23-24H2/b20-13-
InChIKeyHSWBVXJQGQTIJW-MOSHPQCFSA-N
XLogP3.56
TPSA82.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.45
LogP ≤ 53.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(Z)-1-[2-[1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine
CID 170196510
4-[5-iodo-1-[(4-methoxyphenyl)methyl]triazol-4-yl]-2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]pyridine
CID 121282962
N'-methyl-N-methylidene-2-[1-[2-[2-(trifluoromethyl)phenyl]ethyl]imidazol-4-yl]pyridine-4-carboximidamide
CID 123459408
(Z)-1-[2-[1-[2-(2,5-difluorophenyl)ethyl]imidazol-4-yl]-4-pyridinyl]-3,3,3-trifluoro-2-hydrazinylprop-1-en-1-amine
CID 130453065
2-[1-[2-[2-(trifluoromethyl)phenyl]ethyl]imidazol-4-yl]-4-[5-(trifluoromethyl)-2H-triazol-4-yl]pyridine
CID 121290275
(Z)-1-[2-[1-[(2,3-dichlorophenyl)methyl]imidazol-4-yl]-4-pyridinyl]-2-hydrazinylprop-1-en-1-amine
CID 145046214
2-[1-(2-pyrrolidin-1-ylethyl)imidazol-4-yl]pyridine-4-carboxylic acid
CID 90407056
2-[1-(2-pyrrolidin-1-ylethyl)imidazol-4-yl]pyridine-4-carboxylic acid;toluene
CID 144718396
2-[1-[(4-chlorophenyl)methyl]imidazol-4-yl]pyridine-4-carboxamide
CID 90407159
2-(naphthalen-1-ylmethylamino)pyridine-4-carbothioamide
CID 62370127
4,5-dichloro-1-(2-naphthalen-1-ylethyl)imidazole
CID 90161211
2-[5-[1-(2-naphthalen-1-ylethyl)piperidin-4-yl]-1H-pyrazol-3-yl]pyridine
CID 22911520

Frequently Asked Questions

What is the IUPAC name of (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine?
The IUPAC name of (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine (CID 166968745) is (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine.
What is the SMILES notation for (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine?
The canonical SMILES for (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine is N/C=C(\N)c1ccnc(-c2cn(CCc3cccc4ccccc34)cn2)c1.
What is the InChIKey of (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine?
The InChIKey is HSWBVXJQGQTIJW-MOSHPQCFSA-N. The full InChI is InChI=1S/C22H21N5/c23-13-20(24)18-8-10-25-21(12-18)22-14-27(15-26-22)11-9-17-6-3-5-16-4-1-2-7-19(16)17/h1-8,10,12-15H,9,11,23-24H2/b20-13-.
What are the key properties of (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine?
(Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine has a molecular weight of 355.45 g/mol, XLogP of 3.56, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-[2-[1-(2-naphthalen-1-ylethyl)imidazol-4-yl]-4-pyridinyl]ethene-1,2-diamine is sourced from PubChem (CID 166968745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).