[cyclopropyl(methyl)amino]methanol

C5H11NO — CID 89240777

IUPAC[cyclopropyl(methyl)amino]methanol
SMILESCN(CO)C1CC1
InChIInChI=1S/C5H11NO/c1-6(4-7)5-2-3-5/h5,7H,2-4H2,1H3
InChIKeyXBUBAZSWIOVSAI-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.03
Rot. Bonds2

About [cyclopropyl(methyl)amino]methanol

[cyclopropyl(methyl)amino]methanol (PubChem CID 89240777) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is [cyclopropyl(methyl)amino]methanol.

Molecular Properties

Compound Name[cyclopropyl(methyl)amino]methanol
PubChem CID89240777
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name[cyclopropyl(methyl)amino]methanol
SMILESCN(CO)C1CC1
InChIInChI=1S/C5H11NO/c1-6(4-7)5-2-3-5/h5,7H,2-4H2,1H3
InChIKeyXBUBAZSWIOVSAI-UHFFFAOYSA-N
XLogP0.03
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [cyclopropyl(methyl)amino]methanol?
The IUPAC name of [cyclopropyl(methyl)amino]methanol (CID 89240777) is [cyclopropyl(methyl)amino]methanol.
What is the SMILES notation for [cyclopropyl(methyl)amino]methanol?
The canonical SMILES for [cyclopropyl(methyl)amino]methanol is CN(CO)C1CC1.
What is the InChIKey of [cyclopropyl(methyl)amino]methanol?
The InChIKey is XBUBAZSWIOVSAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-6(4-7)5-2-3-5/h5,7H,2-4H2,1H3.
What are the key properties of [cyclopropyl(methyl)amino]methanol?
[cyclopropyl(methyl)amino]methanol has a molecular weight of 101.15 g/mol, XLogP of 0.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclopropyl(methyl)amino]methanol is sourced from PubChem (CID 89240777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).