[cyclohexyl(hydroxymethyl)amino]methanol

C8H17NO2 — CID 14205712

IUPAC[cyclohexyl(hydroxymethyl)amino]methanol
SMILESOCN(CO)C1CCCCC1
InChIInChI=1S/C8H17NO2/c10-6-9(7-11)8-4-2-1-3-5-8/h8,10-11H,1-7H2
InChIKeyPODKYIDWMLYCFN-UHFFFAOYSA-N
MW159.23 g/mol
LogP0.52
Rot. Bonds3

About [cyclohexyl(hydroxymethyl)amino]methanol

[cyclohexyl(hydroxymethyl)amino]methanol (PubChem CID 14205712) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is [cyclohexyl(hydroxymethyl)amino]methanol.

Molecular Properties

Compound Name[cyclohexyl(hydroxymethyl)amino]methanol
PubChem CID14205712
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name[cyclohexyl(hydroxymethyl)amino]methanol
SMILESOCN(CO)C1CCCCC1
InChIInChI=1S/C8H17NO2/c10-6-9(7-11)8-4-2-1-3-5-8/h8,10-11H,1-7H2
InChIKeyPODKYIDWMLYCFN-UHFFFAOYSA-N
XLogP0.52
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-[cyclohexyl(2-hydroxyethyl)amino]ethanol;nickel
CID 88833532
N,N-diethylcycloundecanamine
CID 163828609
N,N-bis(2-chloroethyl)cyclooctanamine
CID 11075940
N,N-dipropylcyclodecanamine
CID 139723962
2-[cyclohexyl(2,2-difluoroethyl)amino]ethanol
CID 62016408
2-[2-chloroprop-2-enyl(cyclopentyl)amino]ethanol
CID 62014468
1-[cyclohexyl(2-hydroxyethyl)amino]-3-methylbutan-2-one
CID 79395277
2-[cyclobutyl(2-hydroxyethyl)amino]-N-cyclohexyl-N-methylacetamide
CID 102676811
[ethyl(piperidin-4-yl)amino]methanol
CID 176656456
4-[2-carboxyethyl(cyclohexyl)amino]butanoic acid
CID 82330575
3-[cyclohexyl(2-hydroxyethyl)amino]propanal
CID 63039607
3-[3-[cyclohexyl(3-hydroxypropyl)amino]propylamino]propan-1-ol
CID 149151262

Frequently Asked Questions

What is the IUPAC name of [cyclohexyl(hydroxymethyl)amino]methanol?
The IUPAC name of [cyclohexyl(hydroxymethyl)amino]methanol (CID 14205712) is [cyclohexyl(hydroxymethyl)amino]methanol.
What is the SMILES notation for [cyclohexyl(hydroxymethyl)amino]methanol?
The canonical SMILES for [cyclohexyl(hydroxymethyl)amino]methanol is OCN(CO)C1CCCCC1.
What is the InChIKey of [cyclohexyl(hydroxymethyl)amino]methanol?
The InChIKey is PODKYIDWMLYCFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO2/c10-6-9(7-11)8-4-2-1-3-5-8/h8,10-11H,1-7H2.
What are the key properties of [cyclohexyl(hydroxymethyl)amino]methanol?
[cyclohexyl(hydroxymethyl)amino]methanol has a molecular weight of 159.23 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohexyl(hydroxymethyl)amino]methanol is sourced from PubChem (CID 14205712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).