1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine

C14H26N4 — CID 106566325

IUPAC1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine
SMILESC=CCNc1nc(C)cn1C(C)CN(CC)CC
InChIInChI=1S/C14H26N4/c1-6-9-15-14-16-12(4)10-18(14)13(5)11-17(7-2)8-3/h6,10,13H,1,7-9,11H2,2-5H3,(H,15,16)
InChIKeyFDNQDKNGNZPNIA-UHFFFAOYSA-N
MW250.39 g/mol
LogP2.69
Rot. Bonds8

About 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine

1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine (PubChem CID 106566325) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine.

Molecular Properties

Compound Name1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine
PubChem CID106566325
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine
SMILESC=CCNc1nc(C)cn1C(C)CN(CC)CC
InChIInChI=1S/C14H26N4/c1-6-9-15-14-16-12(4)10-18(14)13(5)11-17(7-2)8-3/h6,10,13H,1,7-9,11H2,2-5H3,(H,15,16)
InChIKeyFDNQDKNGNZPNIA-UHFFFAOYSA-N
XLogP2.69
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-methyl-1-pentan-2-yl-N-prop-2-enylimidazol-2-amine
CID 106555821
4-methyl-1-(1-methylsulfinylpropan-2-yl)-N-prop-2-enylimidazol-2-amine
CID 106580475
1-[1-(4-bromophenyl)ethyl]-4-methyl-N-prop-2-enylimidazol-2-amine
CID 106566854
1-butan-2-yl-N-ethyl-4-methylimidazol-2-amine
CID 106554895
4-methyl-N-prop-2-enyl-1-[1-(1,3-thiazol-2-yl)propyl]imidazol-2-amine
CID 106574986
1-[4-(dimethylamino)butan-2-yl]-N-ethyl-4-methylimidazol-2-amine
CID 106567736
4-methyl-1-(4-methylpentyl)-N-prop-2-enylimidazol-2-amine
CID 106572182
4-methyl-1-(5-methylhexyl)-N-prop-2-enylimidazol-2-amine
CID 106578451
1-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-4-methyl-N-prop-2-enylimidazol-2-amine
CID 106557756
4-methyl-1-(2-methylsulfanylpropyl)-N-prop-2-enylimidazol-2-amine
CID 106580957
4-methyl-1-(2-methylcyclopropyl)-N-prop-2-enylimidazol-2-amine
CID 106571162
1-[1-(diethylamino)propan-2-yl]-N-ethylimidazol-2-amine
CID 106566350

Frequently Asked Questions

What is the IUPAC name of 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine?
The IUPAC name of 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine (CID 106566325) is 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine.
What is the SMILES notation for 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine?
The canonical SMILES for 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine is C=CCNc1nc(C)cn1C(C)CN(CC)CC.
What is the InChIKey of 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine?
The InChIKey is FDNQDKNGNZPNIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-6-9-15-14-16-12(4)10-18(14)13(5)11-17(7-2)8-3/h6,10,13H,1,7-9,11H2,2-5H3,(H,15,16).
What are the key properties of 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine?
1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine has a molecular weight of 250.39 g/mol, XLogP of 2.69, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(diethylamino)propan-2-yl]-4-methyl-N-prop-2-enylimidazol-2-amine is sourced from PubChem (CID 106566325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).