[4-[2-(methylamino)ethyl]cyclohexyl]methanol

C10H21NO — CID 22236248

IUPAC[4-[2-(methylamino)ethyl]cyclohexyl]methanol
SMILESCNCCC1CCC(CO)CC1
InChIInChI=1S/C10H21NO/c1-11-7-6-9-2-4-10(8-12)5-3-9/h9-12H,2-8H2,1H3
InChIKeyRDCZWRCAQIDMOV-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.39
Rot. Bonds4

About [4-[2-(methylamino)ethyl]cyclohexyl]methanol

[4-[2-(methylamino)ethyl]cyclohexyl]methanol (PubChem CID 22236248) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is [4-[2-(methylamino)ethyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[4-[2-(methylamino)ethyl]cyclohexyl]methanol
PubChem CID22236248
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name[4-[2-(methylamino)ethyl]cyclohexyl]methanol
SMILESCNCCC1CCC(CO)CC1
InChIInChI=1S/C10H21NO/c1-11-7-6-9-2-4-10(8-12)5-3-9/h9-12H,2-8H2,1H3
InChIKeyRDCZWRCAQIDMOV-UHFFFAOYSA-N
XLogP1.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-[2-(methylamino)ethyl]cyclohexyl]methanol?
The IUPAC name of [4-[2-(methylamino)ethyl]cyclohexyl]methanol (CID 22236248) is [4-[2-(methylamino)ethyl]cyclohexyl]methanol.
What is the SMILES notation for [4-[2-(methylamino)ethyl]cyclohexyl]methanol?
The canonical SMILES for [4-[2-(methylamino)ethyl]cyclohexyl]methanol is CNCCC1CCC(CO)CC1.
What is the InChIKey of [4-[2-(methylamino)ethyl]cyclohexyl]methanol?
The InChIKey is RDCZWRCAQIDMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-11-7-6-9-2-4-10(8-12)5-3-9/h9-12H,2-8H2,1H3.
What are the key properties of [4-[2-(methylamino)ethyl]cyclohexyl]methanol?
[4-[2-(methylamino)ethyl]cyclohexyl]methanol has a molecular weight of 171.28 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(methylamino)ethyl]cyclohexyl]methanol is sourced from PubChem (CID 22236248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).