3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol

C13H26N2O3 — CID 114629443

IUPAC3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1NCC(O)CN1CCOCC1
InChIInChI=1S/C13H26N2O3/c1-13(2)11(7-12(13)17)14-8-10(16)9-15-3-5-18-6-4-15/h10-12,14,16-17H,3-9H2,1-2H3
InChIKeyVSAAVQRQTWBSCI-UHFFFAOYSA-N
MW258.36 g/mol
LogP-0.57
Rot. Bonds5

About 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol

3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol (PubChem CID 114629443) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
PubChem CID114629443
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC Name3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
SMILESCC1(C)C(O)CC1NCC(O)CN1CCOCC1
InChIInChI=1S/C13H26N2O3/c1-13(2)11(7-12(13)17)14-8-10(16)9-15-3-5-18-6-4-15/h10-12,14,16-17H,3-9H2,1-2H3
InChIKeyVSAAVQRQTWBSCI-UHFFFAOYSA-N
XLogP-0.57
TPSA64.96 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 5-0.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol with MolForge

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Related Compounds

1-morpholin-4-yl-3-[(2,2,3,3-tetramethylcyclopropyl)amino]propan-2-ol
CID 79359122
2,2-dimethyl-3-[(4-methyl-2-morpholin-4-ylpentyl)amino]cyclobutan-1-ol
CID 115972159
(2S)-1-(methylamino)-3-morpholin-4-ylpropan-2-ol
CID 7201085
2,2-dimethyl-3-[(2-methyl-2-morpholin-4-ylpropyl)amino]cyclobutan-1-ol
CID 112633253
2-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]cyclohexan-1-ol
CID 62360030
3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 112634064
1-(methoxyamino)-3-morpholin-4-ylpropan-2-ol
CID 60702622
1-morpholin-4-yl-3-(morpholin-4-ylamino)propan-2-ol
CID 83022230
2,2-dimethyl-3-(2-piperidin-1-ylpropylamino)cyclobutan-1-ol
CID 112633842
1-(3-methylbut-2-enylamino)-3-morpholin-4-ylpropan-2-ol
CID 103605552
2,2-dimethyl-3-[[3-methyl-2-(4-methylpiperazin-1-yl)butyl]amino]cyclobutan-1-ol
CID 115972353
1-(3-methylpentan-3-ylamino)-3-morpholin-4-ylpropan-2-ol
CID 113296449

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol (CID 114629443) is 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol is CC1(C)C(O)CC1NCC(O)CN1CCOCC1.
What is the InChIKey of 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The InChIKey is VSAAVQRQTWBSCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-13(2)11(7-12(13)17)14-8-10(16)9-15-3-5-18-6-4-15/h10-12,14,16-17H,3-9H2,1-2H3.
What are the key properties of 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol?
3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol has a molecular weight of 258.36 g/mol, XLogP of -0.57, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 114629443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).