1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine

C12H22N6O — CID 97356741

IUPAC1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine
SMILESC1CNC(N2CCN=C2NCCN2CCOCC2)=N1
InChIInChI=1S/C12H22N6O/c1-2-14-11(13-1)18-6-4-16-12(18)15-3-5-17-7-9-19-10-8-17/h1-10H2,(H,13,14)(H,15,16)
InChIKeySAEJWAIIPRBOJM-UHFFFAOYSA-N
MW266.35 g/mol
LogP-1.46
Rot. Bonds3

About 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine

1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine (PubChem CID 97356741) has the molecular formula C12H22N6O and a molecular weight of 266.35 g/mol. Its IUPAC name is 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound Name1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine
PubChem CID97356741
Molecular FormulaC12H22N6O
Molecular Weight266.35 g/mol
Exact Mass266.19
IUPAC Name1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine
SMILESC1CNC(N2CCN=C2NCCN2CCOCC2)=N1
InChIInChI=1S/C12H22N6O/c1-2-14-11(13-1)18-6-4-16-12(18)15-3-5-17-7-9-19-10-8-17/h1-10H2,(H,13,14)(H,15,16)
InChIKeySAEJWAIIPRBOJM-UHFFFAOYSA-N
XLogP-1.46
TPSA64.49 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 5-1.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine?
The IUPAC name of 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine (CID 97356741) is 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine?
The canonical SMILES for 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine is C1CNC(N2CCN=C2NCCN2CCOCC2)=N1.
What is the InChIKey of 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine?
The InChIKey is SAEJWAIIPRBOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O/c1-2-14-11(13-1)18-6-4-16-12(18)15-3-5-17-7-9-19-10-8-17/h1-10H2,(H,13,14)(H,15,16).
What are the key properties of 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine?
1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine has a molecular weight of 266.35 g/mol, XLogP of -1.46, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dihydro-1H-imidazol-2-yl)-N-(2-morpholin-4-ylethyl)-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 97356741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).