2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol

C14H28N2O — CID 112633726

IUPAC2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol
SMILESCC(CN1CCCCC1)NC1CC(O)C1(C)C
InChIInChI=1S/C14H28N2O/c1-11(10-16-7-5-4-6-8-16)15-12-9-13(17)14(12,2)3/h11-13,15,17H,4-10H2,1-3H3
InChIKeyZAIYPJDZSIKNPN-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds4

About 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol

2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol (PubChem CID 112633726) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol
PubChem CID112633726
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol
SMILESCC(CN1CCCCC1)NC1CC(O)C1(C)C
InChIInChI=1S/C14H28N2O/c1-11(10-16-7-5-4-6-8-16)15-12-9-13(17)14(12,2)3/h11-13,15,17H,4-10H2,1-3H3
InChIKeyZAIYPJDZSIKNPN-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1,7,7-trimethyl-N-(1-piperidin-1-ylpropan-2-yl)bicyclo[2.2.1]heptan-2-amine
CID 63450726
2,2-dimethyl-3-(2-piperidin-1-ylpropylamino)cyclobutan-1-ol
CID 112633842
2,2-dimethyl-3-(4-methylsulfanylbutan-2-ylamino)cyclobutan-1-ol
CID 115976765
2,2-dimethyl-3-(3-pyrrolidin-1-ylpropylamino)cyclobutan-1-ol
CID 112633285
3-methyl-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclobutan-1-amine
CID 104860074
3-propan-2-yl-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclobutan-1-amine
CID 103561795
3-[[(1R)-1-cyclopentylethyl]amino]-2,2-dimethylcyclobutan-1-ol
CID 103948487
2-(1-piperidin-1-ylpropan-2-ylamino)cyclobutane-1-carboxylic acid
CID 103247689
7,7-dimethyl-N-(1-piperidin-1-ylpropan-2-yl)-2-oxabicyclo[3.2.0]heptan-6-amine
CID 64864093
3-methyl-N-(1-piperidin-1-ylpropan-2-yl)cyclohexan-1-amine
CID 43434988
3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 114629443
N-[(2,2-dimethylcyclopropyl)methyl]-1-piperidin-1-ylpropan-2-amine
CID 107001489

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol?
The IUPAC name of 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol (CID 112633726) is 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol is CC(CN1CCCCC1)NC1CC(O)C1(C)C.
What is the InChIKey of 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol?
The InChIKey is ZAIYPJDZSIKNPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11(10-16-7-5-4-6-8-16)15-12-9-13(17)14(12,2)3/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol?
2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(1-piperidin-1-ylpropan-2-ylamino)cyclobutan-1-ol is sourced from PubChem (CID 112633726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).