3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol

C13H25NO — CID 103948487

IUPAC3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol
SMILESC[C@@H](NC1CC(O)C1(C)C)C1CCCC1
InChIInChI=1S/C13H25NO/c1-9(10-6-4-5-7-10)14-11-8-12(15)13(11,2)3/h9-12,14-15H,4-8H2,1-3H3/t9-,11?,12?/m1/s1
InChIKeyUPWBJISLBZSDNK-OIKLOGQESA-N
MW211.35 g/mol
LogP2.31
Rot. Bonds3

About 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol

3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol (PubChem CID 103948487) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol
PubChem CID103948487
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol
SMILESC[C@@H](NC1CC(O)C1(C)C)C1CCCC1
InChIInChI=1S/C13H25NO/c1-9(10-6-4-5-7-10)14-11-8-12(15)13(11,2)3/h9-12,14-15H,4-8H2,1-3H3/t9-,11?,12?/m1/s1
InChIKeyUPWBJISLBZSDNK-OIKLOGQESA-N
XLogP2.31
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol with MolForge

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Related Compounds

N-[(1S)-1-cycloheptylethyl]-2,2,5,5-tetramethyloxolan-3-amine
CID 81391451
2-cyclopropyl-2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]acetic acid
CID 103267221
N-(1-cyclopentylethyl)-2,2,3,3-tetramethylcyclopropan-1-amine
CID 79359064
3-(cyclopropylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633086
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propane-1,3-diol
CID 112634110
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]propanamide
CID 112633408
3-(1-methoxypropan-2-ylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633134
2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol
CID 112633726
N-[(1S)-1-cycloheptylethyl]cycloheptanamine
CID 81389840
2,2-dimethyl-3-(4-methylsulfanylbutan-2-ylamino)cyclobutan-1-ol
CID 115976765
3-[[(2R)-1-hydroxybutan-2-yl]amino]-2,2-dimethylcyclobutan-1-ol
CID 103952275
3-[(2,2-dimethylcyclohexyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 112634164

Frequently Asked Questions

What is the IUPAC name of 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol (CID 103948487) is 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol is C[C@@H](NC1CC(O)C1(C)C)C1CCCC1.
What is the InChIKey of 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol?
The InChIKey is UPWBJISLBZSDNK-OIKLOGQESA-N. The full InChI is InChI=1S/C13H25NO/c1-9(10-6-4-5-7-10)14-11-8-12(15)13(11,2)3/h9-12,14-15H,4-8H2,1-3H3/t9-,11?,12?/m1/s1.
What are the key properties of 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol?
3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol has a molecular weight of 211.35 g/mol, XLogP of 2.31, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 103948487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).