N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

C11H21N3O — CID 120972737

IUPACN-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCOCC1(CNC2=NCCN2C)CCC1
InChIInChI=1S/C11H21N3O/c1-14-7-6-12-10(14)13-8-11(9-15-2)4-3-5-11/h3-9H2,1-2H3,(H,12,13)
InChIKeyIGKLIUWXBIXOTL-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.69
Rot. Bonds4

About N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine

N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (PubChem CID 120972737) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.

Molecular Properties

Compound NameN-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
PubChem CID120972737
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
SMILESCOCC1(CNC2=NCCN2C)CCC1
InChIInChI=1S/C11H21N3O/c1-14-7-6-12-10(14)13-8-11(9-15-2)4-3-5-11/h3-9H2,1-2H3,(H,12,13)
InChIKeyIGKLIUWXBIXOTL-UHFFFAOYSA-N
XLogP0.69
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(2-methoxyethyl)cyclohexyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 120972263
N-[(1-ethylcyclopentyl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971656
N-[[1-(dimethylamino)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120972304
N-[[1-[(3-chlorophenyl)methyl]cyclopropyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 122098622
N-(cyclooctylmethyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 120970289
N-[[1-(3,4-dimethoxyphenyl)cyclohexyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971296
1-methyl-N-[(1-phenylsulfanylcyclopropyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120971227
N'-(2-methoxyethyl)-N'-methyl-N-(1-methyl-4,5-dihydroimidazol-2-yl)ethane-1,2-diamine;hydroiodide
CID 120970734
1-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120972593
1-methyl-N-(2-piperidin-1-ylethyl)-4,5-dihydroimidazol-2-amine
CID 120969301
N-[2-(azepan-1-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 120969889
1-methyl-N-[(1-methyl-3,4-dihydro-2H-naphthalen-1-yl)methyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971974

Frequently Asked Questions

What is the IUPAC name of N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The IUPAC name of N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine (CID 120972737) is N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine.
What is the SMILES notation for N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The canonical SMILES for N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is COCC1(CNC2=NCCN2C)CCC1.
What is the InChIKey of N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
The InChIKey is IGKLIUWXBIXOTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-14-7-6-12-10(14)13-8-11(9-15-2)4-3-5-11/h3-9H2,1-2H3,(H,12,13).
What are the key properties of N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine?
N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine has a molecular weight of 211.31 g/mol, XLogP of 0.69, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(methoxymethyl)cyclobutyl]methyl]-1-methyl-4,5-dihydroimidazol-2-amine is sourced from PubChem (CID 120972737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).