2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol

C12H23NO2 — CID 112553163

IUPAC2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol
SMILESCCOC1CC(NCC2CCCC2O)C1
InChIInChI=1S/C12H23NO2/c1-2-15-11-6-10(7-11)13-8-9-4-3-5-12(9)14/h9-14H,2-8H2,1H3
InChIKeyHYPBDVGXWMEKOD-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.30
Rot. Bonds5

About 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol

2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol (PubChem CID 112553163) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol
PubChem CID112553163
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol
SMILESCCOC1CC(NCC2CCCC2O)C1
InChIInChI=1S/C12H23NO2/c1-2-15-11-6-10(7-11)13-8-9-4-3-5-12(9)14/h9-14H,2-8H2,1H3
InChIKeyHYPBDVGXWMEKOD-UHFFFAOYSA-N
XLogP1.30
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
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-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 106824409
trans-(1R,2R)-2-[(cyclohexylamino)methyl]cyclopentan-1-ol
CID 15716295
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-3-ethoxycyclobutan-1-amine
CID 102610282
2-[[(3-ethylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64926892
cis-(1R,2S)-2-[[[(1S,3R)-3-ethylcyclohexyl]amino]methyl]cyclohexan-1-ol
CID 124834672
2-[[(3-methylcyclohexyl)amino]methyl]cyclohexan-1-ol
CID 64929988
2-[(cycloheptylamino)methyl]cyclohexan-1-ol
CID 64928206
2-[(thietan-3-ylamino)methyl]cyclopentan-1-ol
CID 130951867
2-[[(4-aminocyclohexyl)amino]methyl]cyclopentan-1-ol
CID 79741802
3-ethoxy-N-ethylcyclohexan-1-amine
CID 79619303
2-[(azepan-4-ylamino)methyl]cyclopentan-1-ol
CID 103982373
4-[(2-hydroxycyclopentyl)methylamino]cyclohexane-1-carboxylic acid
CID 112753604

Frequently Asked Questions

What is the IUPAC name of 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol?
The IUPAC name of 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol (CID 112553163) is 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol is CCOC1CC(NCC2CCCC2O)C1.
What is the InChIKey of 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol?
The InChIKey is HYPBDVGXWMEKOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-2-15-11-6-10(7-11)13-8-9-4-3-5-12(9)14/h9-14H,2-8H2,1H3.
What are the key properties of 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol?
2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol has a molecular weight of 213.32 g/mol, XLogP of 1.30, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3-ethoxycyclobutyl)amino]methyl]cyclopentan-1-ol is sourced from PubChem (CID 112553163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).