N-ethyl-1-(oxan-3-yl)imidazol-2-amine

C10H17N3O — CID 106573282

IUPACN-ethyl-1-(oxan-3-yl)imidazol-2-amine
SMILESCCNc1nccn1C1CCCOC1
InChIInChI=1S/C10H17N3O/c1-2-11-10-12-5-6-13(10)9-4-3-7-14-8-9/h5-6,9H,2-4,7-8H2,1H3,(H,11,12)
InChIKeyDTWWCCZYAKQUNV-UHFFFAOYSA-N
MW195.27 g/mol
LogP1.67
Rot. Bonds3

About N-ethyl-1-(oxan-3-yl)imidazol-2-amine

N-ethyl-1-(oxan-3-yl)imidazol-2-amine (PubChem CID 106573282) has the molecular formula C10H17N3O and a molecular weight of 195.27 g/mol. Its IUPAC name is N-ethyl-1-(oxan-3-yl)imidazol-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(oxan-3-yl)imidazol-2-amine
PubChem CID106573282
Molecular FormulaC10H17N3O
Molecular Weight195.27 g/mol
Exact Mass195.14
IUPAC NameN-ethyl-1-(oxan-3-yl)imidazol-2-amine
SMILESCCNc1nccn1C1CCCOC1
InChIInChI=1S/C10H17N3O/c1-2-11-10-12-5-6-13(10)9-4-3-7-14-8-9/h5-6,9H,2-4,7-8H2,1H3,(H,11,12)
InChIKeyDTWWCCZYAKQUNV-UHFFFAOYSA-N
XLogP1.67
TPSA39.08 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 ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(oxolan-3-yl)imidazol-2-amine
CID 106577306
1-cyclopentyl-N-(oxan-3-yl)imidazol-2-amine
CID 106573279
[1-(oxan-3-yl)imidazol-2-yl]methanamine
CID 84732373
2-[1-(oxan-3-yl)imidazol-2-yl]acetic acid
CID 84734462
N-butyl-1-cyclobutylimidazol-2-amine
CID 106571396
1-cyclopropyl-N-propylimidazol-2-amine
CID 106554744
N-ethyl-4-methyl-1-(oxolan-3-yl)imidazol-2-amine
CID 106577274
1-cyclopropyl-N-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560101
1-cycloheptyl-N-(3-ethoxypropyl)imidazol-2-amine
CID 106561258
1-cyclopentyl-N-(2,3-dimethylbutyl)imidazol-2-amine
CID 106575250
1-cyclopentyl-N-(2-cyclopropylethyl)imidazol-2-amine
CID 106575827
N-[[3-(oxan-3-yl)imidazol-4-yl]methyl]ethanamine
CID 66152226

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(oxan-3-yl)imidazol-2-amine?
The IUPAC name of N-ethyl-1-(oxan-3-yl)imidazol-2-amine (CID 106573282) is N-ethyl-1-(oxan-3-yl)imidazol-2-amine.
What is the SMILES notation for N-ethyl-1-(oxan-3-yl)imidazol-2-amine?
The canonical SMILES for N-ethyl-1-(oxan-3-yl)imidazol-2-amine is CCNc1nccn1C1CCCOC1.
What is the InChIKey of N-ethyl-1-(oxan-3-yl)imidazol-2-amine?
The InChIKey is DTWWCCZYAKQUNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O/c1-2-11-10-12-5-6-13(10)9-4-3-7-14-8-9/h5-6,9H,2-4,7-8H2,1H3,(H,11,12).
What are the key properties of N-ethyl-1-(oxan-3-yl)imidazol-2-amine?
N-ethyl-1-(oxan-3-yl)imidazol-2-amine has a molecular weight of 195.27 g/mol, XLogP of 1.67, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(oxan-3-yl)imidazol-2-amine is sourced from PubChem (CID 106573282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).