[4-(methylaminomethyl)cyclohexyl]methanol

C9H19NO — CID 22236270

IUPAC[4-(methylaminomethyl)cyclohexyl]methanol
SMILESCNCC1CCC(CO)CC1
InChIInChI=1S/C9H19NO/c1-10-6-8-2-4-9(7-11)5-3-8/h8-11H,2-7H2,1H3
InChIKeyUJARIIGRDCMOQX-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.00
Rot. Bonds3

About [4-(methylaminomethyl)cyclohexyl]methanol

[4-(methylaminomethyl)cyclohexyl]methanol (PubChem CID 22236270) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is [4-(methylaminomethyl)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(methylaminomethyl)cyclohexyl]methanol
PubChem CID22236270
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name[4-(methylaminomethyl)cyclohexyl]methanol
SMILESCNCC1CCC(CO)CC1
InChIInChI=1S/C9H19NO/c1-10-6-8-2-4-9(7-11)5-3-8/h8-11H,2-7H2,1H3
InChIKeyUJARIIGRDCMOQX-UHFFFAOYSA-N
XLogP1.00
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(methylaminomethyl)cyclohexyl]methanol?
The IUPAC name of [4-(methylaminomethyl)cyclohexyl]methanol (CID 22236270) is [4-(methylaminomethyl)cyclohexyl]methanol.
What is the SMILES notation for [4-(methylaminomethyl)cyclohexyl]methanol?
The canonical SMILES for [4-(methylaminomethyl)cyclohexyl]methanol is CNCC1CCC(CO)CC1.
What is the InChIKey of [4-(methylaminomethyl)cyclohexyl]methanol?
The InChIKey is UJARIIGRDCMOQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-10-6-8-2-4-9(7-11)5-3-8/h8-11H,2-7H2,1H3.
What are the key properties of [4-(methylaminomethyl)cyclohexyl]methanol?
[4-(methylaminomethyl)cyclohexyl]methanol has a molecular weight of 157.26 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methylaminomethyl)cyclohexyl]methanol is sourced from PubChem (CID 22236270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).