1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine

C11H17N5 — CID 82903281

IUPAC1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
SMILESCCn1ccnc1C(NC)c1cncn1C
InChIInChI=1S/C11H17N5/c1-4-16-6-5-14-11(16)10(12-2)9-7-13-8-15(9)3/h5-8,10,12H,4H2,1-3H3
InChIKeyQNKPQPXMPFJQQE-UHFFFAOYSA-N
MW219.29 g/mol
LogP0.95
Rot. Bonds4

About 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine

1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine (PubChem CID 82903281) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine.

Molecular Properties

Compound Name1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
PubChem CID82903281
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC Name1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
SMILESCCn1ccnc1C(NC)c1cncn1C
InChIInChI=1S/C11H17N5/c1-4-16-6-5-14-11(16)10(12-2)9-7-13-8-15(9)3/h5-8,10,12H,4H2,1-3H3
InChIKeyQNKPQPXMPFJQQE-UHFFFAOYSA-N
XLogP0.95
TPSA47.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethylimidazol-2-yl)-(3-methylimidazol-4-yl)methyl]ethanamine
CID 82903316
(3-methylimidazol-4-yl)-(1-propylimidazol-2-yl)methanol
CID 66117982
1-(1-ethylimidazol-2-yl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 65195336
2-(1-ethylimidazol-2-yl)-1-(3-methylimidazol-4-yl)ethanol
CID 79744158
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915
1-(4-chlorophenyl)-1-(1-ethylimidazol-2-yl)-N-methylmethanamine
CID 61316350
1-(1-ethylimidazol-2-yl)-N-methyl-1-(1,3-thiazol-4-yl)methanamine
CID 63022367
3-(1-ethylimidazol-2-yl)-N-methylbutan-2-amine
CID 63199792
N-methyl-1-(3-methylimidazol-4-yl)propan-1-amine
CID 82903287
N-methyl-1-(1-propylimidazol-2-yl)-1-pyridin-3-ylmethanamine
CID 61318146
N-methyl-1-(3-methylimidazol-4-yl)-1-(4-propoxyphenyl)methanamine
CID 82903609
1-(3,5-dimethylphenyl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine
CID 82902598

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine?
The IUPAC name of 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine (CID 82903281) is 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine.
What is the SMILES notation for 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine?
The canonical SMILES for 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine is CCn1ccnc1C(NC)c1cncn1C.
What is the InChIKey of 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine?
The InChIKey is QNKPQPXMPFJQQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-4-16-6-5-14-11(16)10(12-2)9-7-13-8-15(9)3/h5-8,10,12H,4H2,1-3H3.
What are the key properties of 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine?
1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine has a molecular weight of 219.29 g/mol, XLogP of 0.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethylimidazol-2-yl)-N-methyl-1-(3-methylimidazol-4-yl)methanamine is sourced from PubChem (CID 82903281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).