[1-(cyclobutylmethylamino)cyclohexyl]methanol

C12H23NO — CID 65459866

IUPAC[1-(cyclobutylmethylamino)cyclohexyl]methanol
SMILESOCC1(NCC2CCC2)CCCCC1
InChIInChI=1S/C12H23NO/c14-10-12(7-2-1-3-8-12)13-9-11-5-4-6-11/h11,13-14H,1-10H2
InChIKeyFRDGVIVCGHROHL-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.07
Rot. Bonds4

About [1-(cyclobutylmethylamino)cyclohexyl]methanol

[1-(cyclobutylmethylamino)cyclohexyl]methanol (PubChem CID 65459866) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is [1-(cyclobutylmethylamino)cyclohexyl]methanol.

Molecular Properties

Compound Name[1-(cyclobutylmethylamino)cyclohexyl]methanol
PubChem CID65459866
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name[1-(cyclobutylmethylamino)cyclohexyl]methanol
SMILESOCC1(NCC2CCC2)CCCCC1
InChIInChI=1S/C12H23NO/c14-10-12(7-2-1-3-8-12)13-9-11-5-4-6-11/h11,13-14H,1-10H2
InChIKeyFRDGVIVCGHROHL-UHFFFAOYSA-N
XLogP2.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(cyclobutylmethylamino)cyclohexyl]methanol?
The IUPAC name of [1-(cyclobutylmethylamino)cyclohexyl]methanol (CID 65459866) is [1-(cyclobutylmethylamino)cyclohexyl]methanol.
What is the SMILES notation for [1-(cyclobutylmethylamino)cyclohexyl]methanol?
The canonical SMILES for [1-(cyclobutylmethylamino)cyclohexyl]methanol is OCC1(NCC2CCC2)CCCCC1.
What is the InChIKey of [1-(cyclobutylmethylamino)cyclohexyl]methanol?
The InChIKey is FRDGVIVCGHROHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c14-10-12(7-2-1-3-8-12)13-9-11-5-4-6-11/h11,13-14H,1-10H2.
What are the key properties of [1-(cyclobutylmethylamino)cyclohexyl]methanol?
[1-(cyclobutylmethylamino)cyclohexyl]methanol has a molecular weight of 197.32 g/mol, XLogP of 2.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclobutylmethylamino)cyclohexyl]methanol is sourced from PubChem (CID 65459866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).