N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine

C26H21N3 — CID 25141344

IUPACN-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine
SMILESc1ccc(C(c2ccc(Nc3ccc4ccccc4c3)cc2)n2ccnc2)cc1
InChIInChI=1S/C26H21N3/c1-2-7-21(8-3-1)26(29-17-16-27-19-29)22-11-13-24(14-12-22)28-25-15-10-20-6-4-5-9-23(20)18-25/h1-19,26,28H
InChIKeyDOYQKEVQXQZQNF-UHFFFAOYSA-N
MW375.48 g/mol
LogP6.42
Rot. Bonds5

About N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine

N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine (PubChem CID 25141344) has the molecular formula C26H21N3 and a molecular weight of 375.48 g/mol. Its IUPAC name is N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine.

Molecular Properties

Compound NameN-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine
PubChem CID25141344
Molecular FormulaC26H21N3
Molecular Weight375.48 g/mol
Exact Mass375.17
IUPAC NameN-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine
SMILESc1ccc(C(c2ccc(Nc3ccc4ccccc4c3)cc2)n2ccnc2)cc1
InChIInChI=1S/C26H21N3/c1-2-7-21(8-3-1)26(29-17-16-27-19-29)22-11-13-24(14-12-22)28-25-15-10-20-6-4-5-9-23(20)18-25/h1-19,26,28H
InChIKeyDOYQKEVQXQZQNF-UHFFFAOYSA-N
XLogP6.42
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.48
LogP ≤ 56.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(3-Cyano-benzyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2-naphthalen-1-YL-benzonitrile
CID 447390
1-(naphthalen-2-yl)-1H-imidazole
CID 23644748
5-[(3-Cyano-benzyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-2''-methyl-biphenyl-2-carbonitrile
CID 44278126
4,4'-Di(1H-imidazol-1-yl)-1,1'-biphenyl
CID 57393199
1-(Bis-biphenyl-4-yl-methyl)-1H-imidazole
CID 20298212
4-{[(4-Cyano-3-naphthalen-1-yl-phenyl)-(3-methyl-3H-imidazol-4-ylmethyl)-amino]-methyl}-pyridine-2-carbonitrile
CID 44278100
2-[[5-[[3-(2,6-Difluorophenyl)-4-fluoroanilino]methyl]imidazol-1-yl]methyl]-5-phenylaniline
CID 72545104
2-[[5-[(4-Fluoro-3-phenylanilino)methyl]imidazol-1-yl]methyl]-5-phenylaniline
CID 72545332
N-[[3-[(2-amino-4-phenylphenyl)methyl]imidazol-4-yl]methyl]-3-(2,6-difluorophenyl)-4-methylaniline
CID 72545335
1-(4-Phenylphenyl)imidazole
CID 677923
2-Cyano(3-(5-methyl-1H-imidazol-1-yl)propyl)-3-(3,4-dimethylphenyl)guanidine
CID 25054968
2-Cyano-1-[3-(5-methyl-1H-imidazol-1-yl)propyl]-4-phenylbenzene-1-guanidine
CID 25054970

Frequently Asked Questions

What is the IUPAC name of N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine?
The IUPAC name of N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine (CID 25141344) is N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine.
What is the SMILES notation for N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine?
The canonical SMILES for N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine is c1ccc(C(c2ccc(Nc3ccc4ccccc4c3)cc2)n2ccnc2)cc1.
What is the InChIKey of N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine?
The InChIKey is DOYQKEVQXQZQNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H21N3/c1-2-7-21(8-3-1)26(29-17-16-27-19-29)22-11-13-24(14-12-22)28-25-15-10-20-6-4-5-9-23(20)18-25/h1-19,26,28H.
What are the key properties of N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine?
N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine has a molecular weight of 375.48 g/mol, XLogP of 6.42, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[imidazol-1-yl(phenyl)methyl]phenyl]naphthalen-2-amine is sourced from PubChem (CID 25141344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).