5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine

C9H19N3O — CID 79510404

IUPAC5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)COC
InChIInChI=1S/C9H19N3O/c1-4-5-12-8(10)11-6-9(12,2)7-13-3/h4-7H2,1-3H3,(H2,10,11)
InChIKeyCSWBTFMVZHSBSM-UHFFFAOYSA-N
MW185.27 g/mol
LogP0.43
Rot. Bonds4

About 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine

5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine (PubChem CID 79510404) has the molecular formula C9H19N3O and a molecular weight of 185.27 g/mol. Its IUPAC name is 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine.

Molecular Properties

Compound Name5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine
PubChem CID79510404
Molecular FormulaC9H19N3O
Molecular Weight185.27 g/mol
Exact Mass185.15
IUPAC Name5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine
SMILESCCCN1C(N)=NCC1(C)COC
InChIInChI=1S/C9H19N3O/c1-4-5-12-8(10)11-6-9(12,2)7-13-3/h4-7H2,1-3H3,(H2,10,11)
InChIKeyCSWBTFMVZHSBSM-UHFFFAOYSA-N
XLogP0.43
TPSA50.85 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[2-(Diaminomethylideneamino)ethyl-(1-methoxy-2-methylpropan-2-yl)amino]ethyl]guanidine
CID 176530822
2-Tert-butyl-1-(2-methoxyethyl)-1-pentan-3-ylguanidine
CID 55063811
1-Butan-2-yl-1-(2-methoxyethyl)-2-methylguanidine
CID 62358412
1-(2-Methoxyethyl)-2-methyl-1-(2-methylpropyl)guanidine
CID 62360615
1-(2-Methoxyethyl)-1-(3-methoxypropyl)-2-methylguanidine
CID 62360805
2-Tert-butyl-1-ethyl-1-(2-methoxyethyl)guanidine
CID 62361460
2-Tert-butyl-1-(2-methoxyethyl)-1-(2-methylpropyl)guanidine
CID 62361465
1-(2-Methoxyethyl)-1,2-bis(2-methylpropyl)guanidine
CID 62361466
2-Ethyl-1-(2-methoxyethyl)-1-(3-methoxypropyl)guanidine
CID 62362134
1-(2-Methoxyethyl)-1-(3-methoxypropyl)-2-propylguanidine
CID 62362347
1-(2-Methoxyethyl)-1-(3-methoxypropyl)-2-propan-2-ylguanidine
CID 62362348
2-Tert-butyl-1-(2-methoxyethyl)-1-(3-methoxypropyl)guanidine
CID 62362350

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The IUPAC name of 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine (CID 79510404) is 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine.
What is the SMILES notation for 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The canonical SMILES for 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine is CCCN1C(N)=NCC1(C)COC.
What is the InChIKey of 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
The InChIKey is CSWBTFMVZHSBSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N3O/c1-4-5-12-8(10)11-6-9(12,2)7-13-3/h4-7H2,1-3H3,(H2,10,11).
What are the key properties of 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine?
5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine has a molecular weight of 185.27 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-5-methyl-1-propyl-4H-imidazol-2-amine is sourced from PubChem (CID 79510404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).