5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine

C10H17N3O2 — CID 67537380

IUPAC5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine
SMILESCOCCNCC1(c2cc(N)no2)CC1
InChIInChI=1S/C10H17N3O2/c1-14-5-4-12-7-10(2-3-10)8-6-9(11)13-15-8/h6,12H,2-5,7H2,1H3,(H2,11,13)
InChIKeyWETMCEZXIUMKQZ-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.52
Rot. Bonds6

About 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine

5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine (PubChem CID 67537380) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine
PubChem CID67537380
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine
SMILESCOCCNCC1(c2cc(N)no2)CC1
InChIInChI=1S/C10H17N3O2/c1-14-5-4-12-7-10(2-3-10)8-6-9(11)13-15-8/h6,12H,2-5,7H2,1H3,(H2,11,13)
InChIKeyWETMCEZXIUMKQZ-UHFFFAOYSA-N
XLogP0.52
TPSA73.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[[1-(3,5-difluorophenyl)cyclopropyl]methyl]-2-methoxyethanamine
CID 62595001
N-[[1-(4-chlorophenyl)cyclopropyl]methyl]-2-methoxyethanamine
CID 62596223
2-methoxy-N-[(1-pyridin-4-ylcyclobutyl)methyl]ethanamine
CID 80525289
N-[[4-(3,4-dichlorophenyl)oxan-4-yl]methyl]-2-methoxyethanamine
CID 62594975
2-(4,4-dimethylcyclohexen-1-yl)-4-[4-[(2-methoxyethylamino)methyl]oxan-4-yl]aniline
CID 69451809
2-methoxy-N-[(1-pyridin-4-ylcyclopent-3-en-1-yl)methyl]ethanamine
CID 80525666
2-methoxy-N-[[5-(4-methylphenyl)spiro[2.3]hexan-5-yl]methyl]ethanamine
CID 65008191
N-[[5-(3-fluorophenyl)spiro[2.3]hexan-5-yl]methyl]-2-methoxyethanamine
CID 65008662
N-[[1-(3-fluorophenyl)cycloheptyl]methyl]-2-methoxyethanamine
CID 62596617
N-[[1-(2,4-dichlorophenyl)cyclopentyl]methyl]-2-methoxyethanamine
CID 62595688
2-methoxy-N-[[1-(4-methoxyphenyl)cyclohexyl]methyl]ethanamine
CID 62596604
N-[[1-(aminomethyl)cyclobutyl]methyl]-2-methoxyethanamine
CID 115449017

Frequently Asked Questions

What is the IUPAC name of 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine?
The IUPAC name of 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine (CID 67537380) is 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine.
What is the SMILES notation for 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine?
The canonical SMILES for 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine is COCCNCC1(c2cc(N)no2)CC1.
What is the InChIKey of 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine?
The InChIKey is WETMCEZXIUMKQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-14-5-4-12-7-10(2-3-10)8-6-9(11)13-15-8/h6,12H,2-5,7H2,1H3,(H2,11,13).
What are the key properties of 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine?
5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine has a molecular weight of 211.26 g/mol, XLogP of 0.52, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(2-methoxyethylamino)methyl]cyclopropyl]-1,2-oxazol-3-amine is sourced from PubChem (CID 67537380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).