1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine

C13H15Cl2N3 — CID 79521672

IUPAC1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine
SMILESNC1=NCC(c2cccc(Cl)c2Cl)N1CC1CC1
InChIInChI=1S/C13H15Cl2N3/c14-10-3-1-2-9(12(10)15)11-6-17-13(16)18(11)7-8-4-5-8/h1-3,8,11H,4-7H2,(H2,16,17)
InChIKeyVHSSIVXMCMIKFO-UHFFFAOYSA-N
MW284.19 g/mol
LogP3.07
Rot. Bonds3

About 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine

1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine (PubChem CID 79521672) has the molecular formula C13H15Cl2N3 and a molecular weight of 284.19 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine
PubChem CID79521672
Molecular FormulaC13H15Cl2N3
Molecular Weight284.19 g/mol
Exact Mass283.06
IUPAC Name1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine
SMILESNC1=NCC(c2cccc(Cl)c2Cl)N1CC1CC1
InChIInChI=1S/C13H15Cl2N3/c14-10-3-1-2-9(12(10)15)11-6-17-13(16)18(11)7-8-4-5-8/h1-3,8,11H,4-7H2,(H2,16,17)
InChIKeyVHSSIVXMCMIKFO-UHFFFAOYSA-N
XLogP3.07
TPSA41.62 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.19
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine (CID 79521672) is 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine is NC1=NCC(c2cccc(Cl)c2Cl)N1CC1CC1.
What is the InChIKey of 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is VHSSIVXMCMIKFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N3/c14-10-3-1-2-9(12(10)15)11-6-17-13(16)18(11)7-8-4-5-8/h1-3,8,11H,4-7H2,(H2,16,17).
What are the key properties of 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine?
1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 284.19 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-5-(2,3-dichlorophenyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 79521672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).