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

C11H21N3O — CID 114527764

IUPAC1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine
SMILESCOCC(C)(C)NCCc1nccn1C
InChIInChI=1S/C11H21N3O/c1-11(2,9-15-4)13-6-5-10-12-7-8-14(10)3/h7-8,13H,5-6,9H2,1-4H3
InChIKeySQVRTCTXEAHLSQ-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.98
Rot. Bonds6

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

1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine (PubChem CID 114527764) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine.

Molecular Properties

Compound Name1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine
PubChem CID114527764
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine
SMILESCOCC(C)(C)NCCc1nccn1C
InChIInChI=1S/C11H21N3O/c1-11(2,9-15-4)13-6-5-10-12-7-8-14(10)3/h7-8,13H,5-6,9H2,1-4H3
InChIKeySQVRTCTXEAHLSQ-UHFFFAOYSA-N
XLogP0.98
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 ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pentan-3-amine
CID 106328740
N'-tert-butyl-N-[2-(1-methylimidazol-2-yl)ethyl]ethane-1,2-diamine
CID 107445440
2-methyl-N-[3-(1-methylimidazol-2-yl)propyl]propan-2-amine
CID 64503751
1-methoxy-2-methyl-3-(1-methylimidazol-2-yl)propan-2-ol
CID 79744678
1-chloro-3-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]pentan-3-amine
CID 106167285
2,2-dimethoxy-N-[2-(1-methylimidazol-2-yl)ethyl]ethanamine
CID 63696362
N-[2-(1-methylimidazol-2-yl)ethyl]propan-1-amine
CID 61214414
1,1-dimethyl-2-[2-(1-methylimidazol-2-yl)ethyl]hydrazine
CID 114527728
N-[2-(1-methylimidazol-2-yl)ethyl]pentan-1-amine
CID 61214559
N-[2-(3-methoxypropoxy)ethyl]-2-(1-methylimidazol-2-yl)ethanamine
CID 103178855
1-methyl-2-[3-(1-methylimidazol-2-yl)propyl]imidazole
CID 67392091
tert-butyl N-[4-[2-(1-methylimidazol-2-yl)ethylamino]cyclohexyl]carbamate
CID 103715474

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine?
The IUPAC name of 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine (CID 114527764) is 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine.
What is the SMILES notation for 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine?
The canonical SMILES for 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine is COCC(C)(C)NCCc1nccn1C.
What is the InChIKey of 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine?
The InChIKey is SQVRTCTXEAHLSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-11(2,9-15-4)13-6-5-10-12-7-8-14(10)3/h7-8,13H,5-6,9H2,1-4H3.
What are the key properties of 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine?
1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine has a molecular weight of 211.31 g/mol, XLogP of 0.98, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-methyl-N-[2-(1-methylimidazol-2-yl)ethyl]propan-2-amine is sourced from PubChem (CID 114527764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).