oxolan-2-yl-(1-propylimidazol-2-yl)methanamine

C11H19N3O — CID 65331088

IUPACoxolan-2-yl-(1-propylimidazol-2-yl)methanamine
SMILESCCCn1ccnc1C(N)C1CCCO1
InChIInChI=1S/C11H19N3O/c1-2-6-14-7-5-13-11(14)10(12)9-4-3-8-15-9/h5,7,9-10H,2-4,6,8,12H2,1H3
InChIKeyRTQMEGBIBVXDOX-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.47
Rot. Bonds4

About oxolan-2-yl-(1-propylimidazol-2-yl)methanamine

oxolan-2-yl-(1-propylimidazol-2-yl)methanamine (PubChem CID 65331088) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is oxolan-2-yl-(1-propylimidazol-2-yl)methanamine.

Molecular Properties

Compound Nameoxolan-2-yl-(1-propylimidazol-2-yl)methanamine
PubChem CID65331088
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Nameoxolan-2-yl-(1-propylimidazol-2-yl)methanamine
SMILESCCCn1ccnc1C(N)C1CCCO1
InChIInChI=1S/C11H19N3O/c1-2-6-14-7-5-13-11(14)10(12)9-4-3-8-15-9/h5,7,9-10H,2-4,6,8,12H2,1H3
InChIKeyRTQMEGBIBVXDOX-UHFFFAOYSA-N
XLogP1.47
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-ethylimidazol-2-yl)-(oxan-2-yl)methanamine
CID 115860223
N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine
CID 65328911
oxan-3-yl-(1-propylimidazol-2-yl)methanamine
CID 65332241
N-[oxan-2-yl-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 115859031
(2-methylcyclopropyl)-(1-propylimidazol-2-yl)methanamine
CID 65420833
N-methyl-1-(oxolan-2-yl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79761761
2-cyclopentyl-1-(1-propylimidazol-2-yl)ethanamine
CID 115858989
1-(oxan-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821107
oxolan-2-yl-(1-propylpyrazol-4-yl)methanamine
CID 65331147
(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol
CID 79087761
N-methyl-1-(oxan-3-yl)-1-(1-propylimidazol-2-yl)methanamine
CID 65332085
(3-methyloxolan-2-yl)-(1-propylimidazol-2-yl)methanol
CID 115799314

Frequently Asked Questions

What is the IUPAC name of oxolan-2-yl-(1-propylimidazol-2-yl)methanamine?
The IUPAC name of oxolan-2-yl-(1-propylimidazol-2-yl)methanamine (CID 65331088) is oxolan-2-yl-(1-propylimidazol-2-yl)methanamine.
What is the SMILES notation for oxolan-2-yl-(1-propylimidazol-2-yl)methanamine?
The canonical SMILES for oxolan-2-yl-(1-propylimidazol-2-yl)methanamine is CCCn1ccnc1C(N)C1CCCO1.
What is the InChIKey of oxolan-2-yl-(1-propylimidazol-2-yl)methanamine?
The InChIKey is RTQMEGBIBVXDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-2-6-14-7-5-13-11(14)10(12)9-4-3-8-15-9/h5,7,9-10H,2-4,6,8,12H2,1H3.
What are the key properties of oxolan-2-yl-(1-propylimidazol-2-yl)methanamine?
oxolan-2-yl-(1-propylimidazol-2-yl)methanamine has a molecular weight of 209.29 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-2-yl-(1-propylimidazol-2-yl)methanamine is sourced from PubChem (CID 65331088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).