1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine

C12H21N3O — CID 106567508

IUPAC1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
SMILESCCn1cc(C)nc1NCCC1CCCO1
InChIInChI=1S/C12H21N3O/c1-3-15-9-10(2)14-12(15)13-7-6-11-5-4-8-16-11/h9,11H,3-8H2,1-2H3,(H,13,14)
InChIKeyLQNIHFJVVJFEMK-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.19
Rot. Bonds5

About 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine

1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine (PubChem CID 106567508) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine.

Molecular Properties

Compound Name1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
PubChem CID106567508
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC Name1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine
SMILESCCn1cc(C)nc1NCCC1CCCO1
InChIInChI=1S/C12H21N3O/c1-3-15-9-10(2)14-12(15)13-7-6-11-5-4-8-16-11/h9,11H,3-8H2,1-2H3,(H,13,14)
InChIKeyLQNIHFJVVJFEMK-UHFFFAOYSA-N
XLogP2.19
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-cyclohexylethyl)-1-ethyl-4-methylimidazol-2-amine
CID 106563379
N-(3-ethoxypropyl)-4-methyl-1-(oxolan-2-ylmethyl)imidazol-2-amine
CID 106560091
N-ethyl-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
CID 106563883
N-(3-methoxypropyl)-4-methyl-1-(oxan-2-ylmethyl)imidazol-2-amine
CID 106563918
1-ethyl-4-methyl-N-(3-methylbutyl)imidazol-2-amine
CID 106557328
5-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-2-amine
CID 63208180
1-methyl-N-[2-(oxolan-2-yl)ethyl]pyrazol-4-amine
CID 79770820
6-hydrazinyl-2-methyl-N-[2-(oxolan-2-yl)ethyl]pyrimidin-4-amine
CID 80904049
4-methyl-1-(oxolan-2-ylmethyl)-N-phenylimidazol-2-amine
CID 106560077
5-methyl-N-[2-(oxolan-2-yl)ethyl]-1,3,4-thiadiazol-2-amine
CID 64915181
6-ethoxy-4-N-methyl-2-N-[2-(oxolan-2-yl)ethyl]-1,3,5-triazine-2,4-diamine
CID 80812130
4-methyl-1-[1-(oxolan-2-yl)ethyl]-N-propylimidazol-2-amine
CID 106562062

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The IUPAC name of 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine (CID 106567508) is 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine.
What is the SMILES notation for 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The canonical SMILES for 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine is CCn1cc(C)nc1NCCC1CCCO1.
What is the InChIKey of 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
The InChIKey is LQNIHFJVVJFEMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-3-15-9-10(2)14-12(15)13-7-6-11-5-4-8-16-11/h9,11H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine?
1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine has a molecular weight of 223.32 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-methyl-N-[2-(oxolan-2-yl)ethyl]imidazol-2-amine is sourced from PubChem (CID 106567508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).