[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol

C12H23NO2 — CID 104871558

IUPAC[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol
SMILESCOC1CC(NC2CCCCC2CO)C1
InChIInChI=1S/C12H23NO2/c1-15-11-6-10(7-11)13-12-5-3-2-4-9(12)8-14/h9-14H,2-8H2,1H3
InChIKeyWQRBMCQZSQMZDF-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.30
Rot. Bonds4

About [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol

[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol (PubChem CID 104871558) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol
PubChem CID104871558
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol
SMILESCOC1CC(NC2CCCCC2CO)C1
InChIInChI=1S/C12H23NO2/c1-15-11-6-10(7-11)13-12-5-3-2-4-9(12)8-14/h9-14H,2-8H2,1H3
InChIKeyWQRBMCQZSQMZDF-UHFFFAOYSA-N
XLogP1.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-N-(3-methoxycyclobutyl)cyclohexan-1-amine
CID 104584298
[2-[(4-methoxycyclohexyl)amino]cyclopentyl]methanol
CID 104530328
[2-[(3-methylcyclobutyl)amino]cyclohexyl]methanol
CID 104859822
[2-[(3-methylcyclobutyl)amino]cyclopentyl]methanol
CID 104859835
2-[(3-methoxycyclobutyl)amino]cyclohexan-1-ol
CID 104871484
[2-(cyclopropylamino)cyclopentyl]methanol
CID 83863384
[2-[(3-aminocyclobutyl)amino]cyclopentyl]methanol
CID 106359486
tert-butyl N-[[2-[(3-methoxycyclobutyl)amino]cyclopentyl]methyl]carbamate
CID 104584543
[2-[(2,2-dimethyl-1,3-dioxan-5-yl)amino]cyclohexyl]methanol
CID 106359859
[2-(ethoxyamino)cyclohexyl]methanol
CID 175246547
[2-(thiolan-3-ylamino)cyclohexyl]methanol
CID 103784945
[2-[(2-propan-2-yloxan-4-yl)amino]cyclohexyl]methanol
CID 103930700

Frequently Asked Questions

What is the IUPAC name of [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol?
The IUPAC name of [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol (CID 104871558) is [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol.
What is the SMILES notation for [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol?
The canonical SMILES for [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol is COC1CC(NC2CCCCC2CO)C1.
What is the InChIKey of [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol?
The InChIKey is WQRBMCQZSQMZDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-15-11-6-10(7-11)13-12-5-3-2-4-9(12)8-14/h9-14H,2-8H2,1H3.
What are the key properties of [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol?
[2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol has a molecular weight of 213.32 g/mol, XLogP of 1.30, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-methoxycyclobutyl)amino]cyclohexyl]methanol is sourced from PubChem (CID 104871558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).