[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol

C8H17NO2 — CID 115454729

IUPAC[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
SMILESCOCCNCC1(CO)CC1
InChIInChI=1S/C8H17NO2/c1-11-5-4-9-6-8(7-10)2-3-8/h9-10H,2-7H2,1H3
InChIKeyUOUBDOJMVPBELP-UHFFFAOYSA-N
MW159.23 g/mol
LogP-0.01
Rot. Bonds6

About [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol

[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol (PubChem CID 115454729) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol.

Molecular Properties

Compound Name[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
PubChem CID115454729
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol
SMILESCOCCNCC1(CO)CC1
InChIInChI=1S/C8H17NO2/c1-11-5-4-9-6-8(7-10)2-3-8/h9-10H,2-7H2,1H3
InChIKeyUOUBDOJMVPBELP-UHFFFAOYSA-N
XLogP-0.01
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 5-0.01
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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Frequently Asked Questions

What is the IUPAC name of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The IUPAC name of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol (CID 115454729) is [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol.
What is the SMILES notation for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The canonical SMILES for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol is COCCNCC1(CO)CC1.
What is the InChIKey of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
The InChIKey is UOUBDOJMVPBELP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c1-11-5-4-9-6-8(7-10)2-3-8/h9-10H,2-7H2,1H3.
What are the key properties of [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol?
[1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol has a molecular weight of 159.23 g/mol, XLogP of -0.01, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(2-methoxyethylamino)methyl]cyclopropyl]methanol is sourced from PubChem (CID 115454729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).