[2-(ethoxyamino)cyclohexyl]methanol

C9H19NO2 — CID 175246547

IUPAC[2-(ethoxyamino)cyclohexyl]methanol
SMILESCCONC1CCCCC1CO
InChIInChI=1S/C9H19NO2/c1-2-12-10-9-6-4-3-5-8(9)7-11/h8-11H,2-7H2,1H3
InChIKeyMPYCWRJFRGMKRR-UHFFFAOYSA-N
MW173.26 g/mol
LogP1.08
Rot. Bonds4

About [2-(ethoxyamino)cyclohexyl]methanol

[2-(ethoxyamino)cyclohexyl]methanol (PubChem CID 175246547) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is [2-(ethoxyamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[2-(ethoxyamino)cyclohexyl]methanol
PubChem CID175246547
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name[2-(ethoxyamino)cyclohexyl]methanol
SMILESCCONC1CCCCC1CO
InChIInChI=1S/C9H19NO2/c1-2-12-10-9-6-4-3-5-8(9)7-11/h8-11H,2-7H2,1H3
InChIKeyMPYCWRJFRGMKRR-UHFFFAOYSA-N
XLogP1.08
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethoxy-2-ethylcyclohexan-1-amine
CID 64974958
N-ethoxy-2-(methylaminooxymethyl)cyclohexan-1-amine
CID 22090855
N-ethoxy-2-methylcyclohexan-1-amine
CID 82709111
N-ethoxy-2-methoxycyclohexan-1-amine
CID 82710281
N-ethoxy-2-propan-2-ylcyclohexan-1-amine
CID 82709453
[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
[2-[(4-methoxycyclohexyl)amino]cyclopentyl]methanol
CID 104530328
[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol
CID 104871558
N-[(1S,2S)-2-(hydroxymethyl)cyclohexyl]ethanesulfonamide
CID 86708972
ethyl 2-[[2-(hydroxymethyl)cyclohexyl]amino]butanoate
CID 104696264
3-ethoxy-N-[2-(hydroxymethyl)cyclohexyl]propanamide
CID 103798579
3-[[2-(hydroxymethyl)cyclohexyl]amino]-2-methylpropan-1-ol
CID 104934327

Frequently Asked Questions

What is the IUPAC name of [2-(ethoxyamino)cyclohexyl]methanol?
The IUPAC name of [2-(ethoxyamino)cyclohexyl]methanol (CID 175246547) is [2-(ethoxyamino)cyclohexyl]methanol.
What is the SMILES notation for [2-(ethoxyamino)cyclohexyl]methanol?
The canonical SMILES for [2-(ethoxyamino)cyclohexyl]methanol is CCONC1CCCCC1CO.
What is the InChIKey of [2-(ethoxyamino)cyclohexyl]methanol?
The InChIKey is MPYCWRJFRGMKRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-2-12-10-9-6-4-3-5-8(9)7-11/h8-11H,2-7H2,1H3.
What are the key properties of [2-(ethoxyamino)cyclohexyl]methanol?
[2-(ethoxyamino)cyclohexyl]methanol has a molecular weight of 173.26 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(ethoxyamino)cyclohexyl]methanol is sourced from PubChem (CID 175246547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).