2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine

C9H17N3O — CID 79616214

IUPAC2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
SMILESCNC(c1nccn1C)C(C)OC
InChIInChI=1S/C9H17N3O/c1-7(13-4)8(10-2)9-11-5-6-12(9)3/h5-8,10H,1-4H3
InChIKeyRTQBSUGWPAJXDL-UHFFFAOYSA-N
MW183.25 g/mol
LogP0.72
Rot. Bonds4

About 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine

2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine (PubChem CID 79616214) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
PubChem CID79616214
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
SMILESCNC(c1nccn1C)C(C)OC
InChIInChI=1S/C9H17N3O/c1-7(13-4)8(10-2)9-11-5-6-12(9)3/h5-8,10H,1-4H3
InChIKeyRTQBSUGWPAJXDL-UHFFFAOYSA-N
XLogP0.72
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-2-methoxy-1-(1-methylimidazol-2-yl)propan-1-amine
CID 79615862
N,2-dimethyl-1-(1-methylimidazol-2-yl)butan-1-amine
CID 63974966
2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine
CID 116718762
fluoroform;2-(1-methoxyethyl)-1-methylimidazole
CID 174709320
3-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
CID 63975168
2-ethoxy-N-methyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 64534593
2-(1-methoxypropyl)-1-methylimidazole
CID 118061871
(1R)-1-(1-methylimidazol-2-yl)ethanamine
CID 42220137
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915
methane;1-(1-methylimidazol-2-yl)ethanol
CID 174578222
(1S)-1-(1-methylimidazol-2-yl)ethanamine;dihydrochloride
CID 162341662
2,3-dimethyl-1-(1-methylimidazol-2-yl)-N-propylbutan-1-amine
CID 115859990

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine (CID 79616214) is 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine is CNC(c1nccn1C)C(C)OC.
What is the InChIKey of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine?
The InChIKey is RTQBSUGWPAJXDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3O/c1-7(13-4)8(10-2)9-11-5-6-12(9)3/h5-8,10H,1-4H3.
What are the key properties of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine?
2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine has a molecular weight of 183.25 g/mol, XLogP of 0.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine is sourced from PubChem (CID 79616214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).