1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine

C10H17N3O — CID 106721070

IUPAC1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine
SMILESCC(N)Cc1cn(C2CCOC2)cn1
InChIInChI=1S/C10H17N3O/c1-8(11)4-9-5-13(7-12-9)10-2-3-14-6-10/h5,7-8,10H,2-4,6,11H2,1H3
InChIKeyVUUGJRKROKRUFV-UHFFFAOYSA-N
MW195.27 g/mol
LogP0.73
Rot. Bonds3

About 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine

1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine (PubChem CID 106721070) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine.

Molecular Properties

Compound Name1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine
PubChem CID106721070
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC Name1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine
SMILESCC(N)Cc1cn(C2CCOC2)cn1
InChIInChI=1S/C10H17N3O/c1-8(11)4-9-5-13(7-12-9)10-2-3-14-6-10/h5,7-8,10H,2-4,6,11H2,1H3
InChIKeyVUUGJRKROKRUFV-UHFFFAOYSA-N
XLogP0.73
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(oxolan-3-yl)imidazol-4-yl]butan-2-amine
CID 106721304
1-(1-cyclohexylimidazol-4-yl)propan-2-amine
CID 83883478
2-methyl-N-[[1-(oxolan-3-yl)imidazol-4-yl]methyl]propan-1-amine
CID 106720066
[1-(oxan-4-yl)imidazol-4-yl]methanamine
CID 130481927
1-[1-(oxan-4-ylmethyl)imidazol-4-yl]propan-2-amine
CID 106721143
1-(oxan-4-yl)-4-propan-2-ylimidazole
CID 89408707
1-[1-[[4-(2-aminopropyl)imidazol-1-yl]methyl]imidazol-4-yl]propan-2-amine
CID 59827554
1-(oxan-4-yl)imidazol-4-amine
CID 66520755
1-[5-(oxolan-3-yloxy)-2-pyridinyl]propan-2-amine
CID 79800705
1-[1-(2-bicyclo[2.2.1]heptanylmethyl)imidazol-4-yl]propan-2-amine
CID 106721215
1-[1-(oxolan-3-ylmethyl)pyrazol-4-yl]propan-2-amine
CID 62731505
4-ethyl-1-(4-fluorocyclohexyl)imidazole
CID 168900429

Frequently Asked Questions

What is the IUPAC name of 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine?
The IUPAC name of 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine (CID 106721070) is 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine.
What is the SMILES notation for 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine?
The canonical SMILES for 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine is CC(N)Cc1cn(C2CCOC2)cn1.
What is the InChIKey of 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine?
The InChIKey is VUUGJRKROKRUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-8(11)4-9-5-13(7-12-9)10-2-3-14-6-10/h5,7-8,10H,2-4,6,11H2,1H3.
What are the key properties of 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine?
1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine has a molecular weight of 195.27 g/mol, XLogP of 0.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(oxolan-3-yl)imidazol-4-yl]propan-2-amine is sourced from PubChem (CID 106721070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).