N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine

C11H19N3O — CID 106554952

IUPACN-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
SMILESCOCCCn1cc(C)nc1NC1CC1
InChIInChI=1S/C11H19N3O/c1-9-8-14(6-3-7-15-2)11(12-9)13-10-4-5-10/h8,10H,3-7H2,1-2H3,(H,12,13)
InChIKeyFXJISMXFONERAA-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.80
Rot. Bonds6

About N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine

N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine (PubChem CID 106554952) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
PubChem CID106554952
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC NameN-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine
SMILESCOCCCn1cc(C)nc1NC1CC1
InChIInChI=1S/C11H19N3O/c1-9-8-14(6-3-7-15-2)11(12-9)13-10-4-5-10/h8,10H,3-7H2,1-2H3,(H,12,13)
InChIKeyFXJISMXFONERAA-UHFFFAOYSA-N
XLogP1.80
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3-methoxypropyl)-4-methyl-N-(thian-4-yl)imidazol-2-amine
CID 106582144
1-(2-methoxyethyl)-4-methyl-N-(4-methylcyclohexyl)imidazol-2-amine
CID 106560145
N-cyclopentyl-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106554862
1-(3-methoxypropyl)-4-methyl-N-(3-methylcyclohexyl)imidazol-2-amine
CID 106561751
N-(2,2-dimethylcyclopropyl)-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106564748
N-(1,1-dioxothian-4-yl)-1-(2-methoxyethyl)-4-methylimidazol-2-amine
CID 106562574
N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-1-propylpiperidin-4-amine
CID 106568414
1-(3-methoxypropyl)-4-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]imidazol-2-amine
CID 106563052
1-(2-methoxyethyl)-4-methyl-N-(oxolan-3-yl)imidazol-2-amine
CID 106577277
N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-1,2-dimethylpiperidin-4-amine
CID 106578397
N-[1-(2-methoxyethyl)-4-methylimidazol-2-yl]-9-methyl-9-azabicyclo[3.3.1]nonan-3-amine
CID 106574276
N-(2-cyclohexylethyl)-1-(3-methoxypropyl)-4-methylimidazol-2-amine
CID 106563359

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine?
The IUPAC name of N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine (CID 106554952) is N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine.
What is the SMILES notation for N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine?
The canonical SMILES for N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine is COCCCn1cc(C)nc1NC1CC1.
What is the InChIKey of N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine?
The InChIKey is FXJISMXFONERAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-9-8-14(6-3-7-15-2)11(12-9)13-10-4-5-10/h8,10H,3-7H2,1-2H3,(H,12,13).
What are the key properties of N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine?
N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine has a molecular weight of 209.29 g/mol, XLogP of 1.80, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-(3-methoxypropyl)-4-methylimidazol-2-amine is sourced from PubChem (CID 106554952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).