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

C11H21N3O — CID 116718762

IUPAC2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine
SMILESCCCC(OC)C(NC)c1nccn1C
InChIInChI=1S/C11H21N3O/c1-5-6-9(15-4)10(12-2)11-13-7-8-14(11)3/h7-10,12H,5-6H2,1-4H3
InChIKeyHRIYBEGBWJTXIC-UHFFFAOYSA-N
MW211.31 g/mol
LogP1.50
Rot. Bonds6

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

2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine (PubChem CID 116718762) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine
PubChem CID116718762
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine
SMILESCCCC(OC)C(NC)c1nccn1C
InChIInChI=1S/C11H21N3O/c1-5-6-9(15-4)10(12-2)11-13-7-8-14(11)3/h7-10,12H,5-6H2,1-4H3
InChIKeyHRIYBEGBWJTXIC-UHFFFAOYSA-N
XLogP1.50
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dimethyl-1-(1-methylimidazol-2-yl)butan-1-amine
CID 63974966
2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
CID 79616214
2-methyl-1-(1-methylimidazol-2-yl)-N-propylpentan-1-amine
CID 115860076
N-ethyl-2-methoxy-1-(1-methylimidazol-2-yl)propan-1-amine
CID 79615862
3-methoxy-N-methyl-1-(1-methylimidazol-2-yl)propan-1-amine
CID 63975168
2-(1-methoxypropyl)-1-methylimidazole
CID 118061871
2-(1-bromobutyl)-1-methylimidazole
CID 175381237
1-(1-methylimidazol-2-yl)-2-propylpentan-1-ol
CID 115799892
2-(1-methylimidazol-2-yl)pentan-1-amine
CID 116834928
2,3-dimethyl-1-(1-methylimidazol-2-yl)-N-propylbutan-1-amine
CID 115859990
2-ethoxy-N-methyl-1-(1-propylimidazol-2-yl)propan-1-amine
CID 64534593
1-(1-ethylimidazol-2-yl)-N,2-dimethylpropan-1-amine
CID 63967915

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine (CID 116718762) is 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine is CCCC(OC)C(NC)c1nccn1C.
What is the InChIKey of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine?
The InChIKey is HRIYBEGBWJTXIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-5-6-9(15-4)10(12-2)11-13-7-8-14(11)3/h7-10,12H,5-6H2,1-4H3.
What are the key properties of 2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine?
2-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 1.50, 6 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)pentan-1-amine is sourced from PubChem (CID 116718762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).