1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine

C14H25N3O — CID 122565585

IUPAC1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
SMILESCCc1nccn1CC(C)NCC1(COC)CC1
InChIInChI=1S/C14H25N3O/c1-4-13-15-7-8-17(13)9-12(2)16-10-14(5-6-14)11-18-3/h7-8,12,16H,4-6,9-11H2,1-3H3
InChIKeyLLRVMUAEWNTBNK-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.85
Rot. Bonds8

About 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine

1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine (PubChem CID 122565585) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine.

Molecular Properties

Compound Name1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
PubChem CID122565585
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine
SMILESCCc1nccn1CC(C)NCC1(COC)CC1
InChIInChI=1S/C14H25N3O/c1-4-13-15-7-8-17(13)9-12(2)16-10-14(5-6-14)11-18-3/h7-8,12,16H,4-6,9-11H2,1-3H3
InChIKeyLLRVMUAEWNTBNK-UHFFFAOYSA-N
XLogP1.85
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chlorophenyl)-N-[1-(2-ethylimidazol-1-yl)propan-2-yl]cyclopropan-1-amine
CID 122568487
1-(4-chlorophenyl)-N-[(2S)-1-(2-ethylimidazol-1-yl)propan-2-yl]cyclopropan-1-amine
CID 125445145
1-(2-ethylimidazol-1-yl)-N-[2-(2-methyl-1,2,4-triazol-3-yl)ethyl]propan-2-amine
CID 131897789
1-(3,5-dimethylpyrazol-1-yl)-N-[[1-(methoxymethyl)cyclobutyl]methyl]propan-2-amine
CID 131916675
(2R)-N-[[1-(methoxymethyl)cyclobutyl]methyl]-3-methyl-1-pyrazol-1-ylbutan-2-amine
CID 124736967
methyl 2-(ethylamino)-4-(2-ethylimidazol-1-yl)butanoate
CID 55143375
3-(2-ethylimidazol-1-yl)-2-(propan-2-ylamino)propan-1-ol
CID 64810311
ethane;2-ethyl-1-(2-methoxyethyl)imidazole
CID 164585283
N-[[1-(methoxymethyl)cyclopropyl]methyl]-1-methylsulfonylpropan-2-amine
CID 131919389
4-[[(2S)-1-(2-ethylimidazol-1-yl)propan-2-yl]amino]-N-phenylpiperidine-1-carboxamide
CID 95128874
N-[2-(2-ethylimidazol-1-yl)ethyl]-3-methylbutan-2-amine
CID 62565130
1-(cyclopropylmethyl)-2-ethylimidazole
CID 63811309

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The IUPAC name of 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine (CID 122565585) is 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine.
What is the SMILES notation for 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The canonical SMILES for 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine is CCc1nccn1CC(C)NCC1(COC)CC1.
What is the InChIKey of 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
The InChIKey is LLRVMUAEWNTBNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-4-13-15-7-8-17(13)9-12(2)16-10-14(5-6-14)11-18-3/h7-8,12,16H,4-6,9-11H2,1-3H3.
What are the key properties of 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine?
1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine has a molecular weight of 251.37 g/mol, XLogP of 1.85, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylimidazol-1-yl)-N-[[1-(methoxymethyl)cyclopropyl]methyl]propan-2-amine is sourced from PubChem (CID 122565585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).