2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine

C10H19N3O — CID 63109492

IUPAC2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine
SMILESCCCc1ncc(CNCCOC)[nH]1
InChIInChI=1S/C10H19N3O/c1-3-4-10-12-8-9(13-10)7-11-5-6-14-2/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyDHVVFJYFQBSFJK-UHFFFAOYSA-N
MW197.28 g/mol
LogP1.10
Rot. Bonds7

About 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine

2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine (PubChem CID 63109492) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound Name2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine
PubChem CID63109492
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine
SMILESCCCc1ncc(CNCCOC)[nH]1
InChIInChI=1S/C10H19N3O/c1-3-4-10-12-8-9(13-10)7-11-5-6-14-2/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyDHVVFJYFQBSFJK-UHFFFAOYSA-N
XLogP1.10
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(2-propyl-1H-imidazol-5-yl)methyl]propan-1-amine
CID 63108587
N-[[2-(tert-butylsulfanylmethyl)-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 65137664
N-[[2-(cyclopentylsulfanylmethyl)-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 65140494
N-[[2-(cyclohexylsulfanylmethyl)-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 65144469
N-[[2-[(2,6-dichlorophenyl)methyl]-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 63109629
2-methoxy-N-[[2-[(2-methoxyphenyl)methyl]-1H-imidazol-5-yl]methyl]ethanamine
CID 63109514
N-methyl-1-(2-propyl-1H-imidazol-5-yl)methanamine
CID 63108982
2-methoxy-N-[[2-(1-methoxy-2-methylpropyl)-1H-imidazol-5-yl]methyl]ethanamine
CID 116732229
N-[[2-[(4-bromophenyl)sulfanylmethyl]-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 66057320
2-methoxy-N-[[2-(1-methoxycycloheptyl)-1H-imidazol-5-yl]methyl]ethanamine
CID 116779879
N-[[2-[(2-chloro-4-fluorophenyl)methyl]-1H-imidazol-5-yl]methyl]-2-methoxyethanamine
CID 63109417
N-[2-(5-propyl-1H-imidazol-2-yl)ethyl]propan-2-amine
CID 114998586

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine?
The IUPAC name of 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine (CID 63109492) is 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine.
What is the SMILES notation for 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine?
The canonical SMILES for 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine is CCCc1ncc(CNCCOC)[nH]1.
What is the InChIKey of 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine?
The InChIKey is DHVVFJYFQBSFJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-4-10-12-8-9(13-10)7-11-5-6-14-2/h8,11H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine?
2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine has a molecular weight of 197.28 g/mol, XLogP of 1.10, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[(2-propyl-1H-imidazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 63109492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).