N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine

C15H28N4O2 — CID 106568545

IUPACN-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
SMILESCOCCCNc1nc(C)cn1C(C)CN1CCOCC1
InChIInChI=1S/C15H28N4O2/c1-13-11-19(15(17-13)16-5-4-8-20-3)14(2)12-18-6-9-21-10-7-18/h11,14H,4-10,12H2,1-3H3,(H,16,17)
InChIKeyPUEISMXTDKEUBF-UHFFFAOYSA-N
MW296.42 g/mol
LogP1.53
Rot. Bonds8

About N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine

N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine (PubChem CID 106568545) has the molecular formula C15H28N4O2 and a molecular weight of 296.42 g/mol. Its IUPAC name is N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
PubChem CID106568545
Molecular FormulaC15H28N4O2
Molecular Weight296.42 g/mol
Exact Mass296.22
IUPAC NameN-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
SMILESCOCCCNc1nc(C)cn1C(C)CN1CCOCC1
InChIInChI=1S/C15H28N4O2/c1-13-11-19(15(17-13)16-5-4-8-20-3)14(2)12-18-6-9-21-10-7-18/h11,14H,4-10,12H2,1-3H3,(H,16,17)
InChIKeyPUEISMXTDKEUBF-UHFFFAOYSA-N
XLogP1.53
TPSA51.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.42
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
CID 106568516
N-(2-methoxyethyl)-4-methyl-1-(1-piperidin-1-ylpropan-2-yl)imidazol-2-amine
CID 106569166
1-(1-methoxypropan-2-yl)-4-methyl-N-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine
CID 106568507
1-[4-(dimethylamino)butan-2-yl]-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106567768
N-(3-methoxypropyl)-4-methyl-1-(1-phenylpropan-2-yl)imidazol-2-amine
CID 106571880
1-(3-methoxypropyl)-4-methyl-N-(2-morpholin-4-ylethyl)imidazol-2-amine
CID 106559331
1-(1-methoxy-3-methylbutan-2-yl)-N-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106575097
1-butan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554900
1-hexan-2-yl-N-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106569745
N-(3-methoxypropyl)-4-methyl-1-(1-pyridin-4-ylethyl)imidazol-2-amine
CID 106562044
1-(1-methoxypropan-2-yl)-4-methyl-N-propylimidazol-2-amine
CID 106554728
N-(3-methoxypropyl)-4-methyl-1-(1-pyridin-2-ylethyl)imidazol-2-amine
CID 106562252

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine?
The IUPAC name of N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine (CID 106568545) is N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine.
What is the SMILES notation for N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine?
The canonical SMILES for N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine is COCCCNc1nc(C)cn1C(C)CN1CCOCC1.
What is the InChIKey of N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine?
The InChIKey is PUEISMXTDKEUBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-13-11-19(15(17-13)16-5-4-8-20-3)14(2)12-18-6-9-21-10-7-18/h11,14H,4-10,12H2,1-3H3,(H,16,17).
What are the key properties of N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine?
N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine has a molecular weight of 296.42 g/mol, XLogP of 1.53, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-4-methyl-1-(1-morpholin-4-ylpropan-2-yl)imidazol-2-amine is sourced from PubChem (CID 106568545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).