[4-(methylamino)cyclohexyl]methanol

C8H17NO — CID 20760612

IUPAC[4-(methylamino)cyclohexyl]methanol
SMILESCNC1CCC(CO)CC1
InChIInChI=1S/C8H17NO/c1-9-8-4-2-7(6-10)3-5-8/h7-10H,2-6H2,1H3
InChIKeyKSQLUMZKNADAFH-UHFFFAOYSA-N
MW143.23 g/mol
LogP0.76
Rot. Bonds2

About [4-(methylamino)cyclohexyl]methanol

[4-(methylamino)cyclohexyl]methanol (PubChem CID 20760612) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is [4-(methylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(methylamino)cyclohexyl]methanol
PubChem CID20760612
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name[4-(methylamino)cyclohexyl]methanol
SMILESCNC1CCC(CO)CC1
InChIInChI=1S/C8H17NO/c1-9-8-4-2-7(6-10)3-5-8/h7-10H,2-6H2,1H3
InChIKeyKSQLUMZKNADAFH-UHFFFAOYSA-N
XLogP0.76
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(methylamino)cyclohexyl]methanol?
The IUPAC name of [4-(methylamino)cyclohexyl]methanol (CID 20760612) is [4-(methylamino)cyclohexyl]methanol.
What is the SMILES notation for [4-(methylamino)cyclohexyl]methanol?
The canonical SMILES for [4-(methylamino)cyclohexyl]methanol is CNC1CCC(CO)CC1.
What is the InChIKey of [4-(methylamino)cyclohexyl]methanol?
The InChIKey is KSQLUMZKNADAFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-9-8-4-2-7(6-10)3-5-8/h7-10H,2-6H2,1H3.
What are the key properties of [4-(methylamino)cyclohexyl]methanol?
[4-(methylamino)cyclohexyl]methanol has a molecular weight of 143.23 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylamino)cyclohexyl]methanol is sourced from PubChem (CID 20760612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).