N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine

C18H19Cl2N3 — CID 44515598

IUPACN-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESClc1cccc(C(CCc2ccccc2)NC2=NCCN2)c1Cl
InChIInChI=1S/C18H19Cl2N3/c19-15-8-4-7-14(17(15)20)16(23-18-21-11-12-22-18)10-9-13-5-2-1-3-6-13/h1-8,16H,9-12H2,(H2,21,22,23)
InChIKeyKHYQXTYSBAGYDM-UHFFFAOYSA-N
MW348.28 g/mol
LogP4.22
Rot. Bonds5

About N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine

N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine (PubChem CID 44515598) has the molecular formula C18H19Cl2N3 and a molecular weight of 348.28 g/mol. Its IUPAC name is N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine.

Molecular Properties

Compound NameN-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine
PubChem CID44515598
Molecular FormulaC18H19Cl2N3
Molecular Weight348.28 g/mol
Exact Mass347.10
IUPAC NameN-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine
SMILESClc1cccc(C(CCc2ccccc2)NC2=NCCN2)c1Cl
InChIInChI=1S/C18H19Cl2N3/c19-15-8-4-7-14(17(15)20)16(23-18-21-11-12-22-18)10-9-13-5-2-1-3-6-13/h1-8,16H,9-12H2,(H2,21,22,23)
InChIKeyKHYQXTYSBAGYDM-UHFFFAOYSA-N
XLogP4.22
TPSA36.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.28
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2,3-dichlorophenyl)-N-methyl-3-phenylpropan-1-amine
CID 63417262
N-[2-(2-bromophenyl)-1-(2,3-dichlorophenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine;N-[1-(3-chlorophenyl)-2-(3-methylphenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine;N-[1-(3-chlorophenyl)-2-phenylethyl]-4,5-dihydro-1H-imidazol-2-amine;3-[2-(2,3-dichlorophenyl)-2-(4,5-dihydro-1H-imidazol-2-ylamino)ethyl]phenol;N-[1-(2,3-dichlorophenyl)-2-(4-fluorophenyl)ethyl]-4,5-dihydro-1H-imidazol-2-amine;N-(1,2-diphenylethyl)-4,5-dihydro-1H-imidazol-2-amine
CID 159699957
1-(2,3-dichlorophenyl)-N-propyl-3-pyridin-3-ylpropan-1-amine
CID 105141906
N-[(4-chlorophenyl)-phenylmethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 22751285
[1-(2-chlorophenyl)-3-phenylpropyl]hydrazine
CID 105205580
N-[2-(2-chloro-4-fluorophenyl)-1-phenylethyl]-4,5-dihydro-1H-imidazol-2-amine
CID 11961273
N-benzyl-4,5-dihydro-1H-imidazol-2-amine;hydroiodide
CID 126766928
1-(3-chloro-2-methylphenyl)-3-phenyl-N-propylpropan-1-amine
CID 107102031
1-(2-chloro-3-methylphenyl)-3-phenyl-N-propylpropan-1-amine
CID 115794374
1-(2,3-dichlorophenyl)-N-ethyl-3-thiophen-3-ylpropan-1-amine
CID 115857101
benzyl 2-(4,5-dihydro-1H-imidazol-2-ylamino)propanoate
CID 170212082
N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine;ethanol
CID 122517146

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine?
The IUPAC name of N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine (CID 44515598) is N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine.
What is the SMILES notation for N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine?
The canonical SMILES for N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine is Clc1cccc(C(CCc2ccccc2)NC2=NCCN2)c1Cl.
What is the InChIKey of N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine?
The InChIKey is KHYQXTYSBAGYDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19Cl2N3/c19-15-8-4-7-14(17(15)20)16(23-18-21-11-12-22-18)10-9-13-5-2-1-3-6-13/h1-8,16H,9-12H2,(H2,21,22,23).
What are the key properties of N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine?
N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine has a molecular weight of 348.28 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,3-dichlorophenyl)-3-phenylpropyl]-4,5-dihydro-1H-imidazol-2-amine is sourced from PubChem (CID 44515598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).