(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine

C15H24N4O2 — CID 59849474

IUPAC(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine
SMILESCC(C)(C)c1cncc(OC[C@@H](N)COC2=NCCN2)c1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)11-6-13(8-17-7-11)20-9-12(16)10-21-14-18-4-5-19-14/h6-8,12H,4-5,9-10,16H2,1-3H3,(H,18,19)/t12-/m1/s1
InChIKeyWEAGEVMDHMGGJJ-GFCCVEGCSA-N
MW292.38 g/mol
LogP1.06
Rot. Bonds5

About (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine

(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine (PubChem CID 59849474) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine.

Molecular Properties

Compound Name(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine
PubChem CID59849474
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine
SMILESCC(C)(C)c1cncc(OC[C@@H](N)COC2=NCCN2)c1
InChIInChI=1S/C15H24N4O2/c1-15(2,3)11-6-13(8-17-7-11)20-9-12(16)10-21-14-18-4-5-19-14/h6-8,12H,4-5,9-10,16H2,1-3H3,(H,18,19)/t12-/m1/s1
InChIKeyWEAGEVMDHMGGJJ-GFCCVEGCSA-N
XLogP1.06
TPSA81.76 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine?
The IUPAC name of (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine (CID 59849474) is (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine.
What is the SMILES notation for (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine?
The canonical SMILES for (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine is CC(C)(C)c1cncc(OC[C@@H](N)COC2=NCCN2)c1.
What is the InChIKey of (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine?
The InChIKey is WEAGEVMDHMGGJJ-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-15(2,3)11-6-13(8-17-7-11)20-9-12(16)10-21-14-18-4-5-19-14/h6-8,12H,4-5,9-10,16H2,1-3H3,(H,18,19)/t12-/m1/s1.
What are the key properties of (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine?
(2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine has a molecular weight of 292.38 g/mol, XLogP of 1.06, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(5-tert-butyl-3-pyridinyl)oxy]-3-(4,5-dihydro-1H-imidazol-2-yloxy)propan-2-amine is sourced from PubChem (CID 59849474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).