3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol

C10H21NO3 — CID 112634064

IUPAC3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol
SMILESCOCC(O)CNC1CC(O)C1(C)C
InChIInChI=1S/C10H21NO3/c1-10(2)8(4-9(10)13)11-5-7(12)6-14-3/h7-9,11-13H,4-6H2,1-3H3
InChIKeyIWSCPDADFCJNDL-UHFFFAOYSA-N
MW203.28 g/mol
LogP-0.26
Rot. Bonds5

About 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol

3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol (PubChem CID 112634064) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol.

Molecular Properties

Compound Name3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol
PubChem CID112634064
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol
SMILESCOCC(O)CNC1CC(O)C1(C)C
InChIInChI=1S/C10H21NO3/c1-10(2)8(4-9(10)13)11-5-7(12)6-14-3/h7-9,11-13H,4-6H2,1-3H3
InChIKeyIWSCPDADFCJNDL-UHFFFAOYSA-N
XLogP-0.26
TPSA61.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 5-0.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-hydroxy-3-(4-methoxyphenoxy)propyl]amino]-2,2-dimethylcyclobutan-1-ol
CID 114629454
3-(1-methoxypropan-2-ylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633134
3-(2-methoxyethylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633105
3-[[3-(2-ethylcyclohexyl)oxy-2-hydroxypropyl]amino]-2,2-dimethylcyclobutan-1-ol
CID 114629568
1-(cyclopropylamino)-3-methoxypropan-2-ol
CID 21034992
3-(ethylamino)-2,2-dimethylcyclobutan-1-ol
CID 112633093
2,2-dimethyl-3-(2-propan-2-yloxyethylamino)cyclobutan-1-ol
CID 104584797
3-[(2-hydroxy-3-morpholin-4-ylpropyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 114629443
3-[2-(3-methoxypropoxy)ethylamino]-2,2-dimethylcyclobutan-1-ol
CID 103179563
3-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-2-methylpropanamide
CID 114629418
2-[(3-hydroxy-2,2-dimethylcyclobutyl)amino]-N-(2-methoxyethyl)acetamide
CID 115977450
1-methoxy-3-(spiro[3.5]nonan-3-ylamino)propan-2-ol
CID 102951950

Frequently Asked Questions

What is the IUPAC name of 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The IUPAC name of 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol (CID 112634064) is 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol.
What is the SMILES notation for 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The canonical SMILES for 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol is COCC(O)CNC1CC(O)C1(C)C.
What is the InChIKey of 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol?
The InChIKey is IWSCPDADFCJNDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-10(2)8(4-9(10)13)11-5-7(12)6-14-3/h7-9,11-13H,4-6H2,1-3H3.
What are the key properties of 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol?
3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol has a molecular weight of 203.28 g/mol, XLogP of -0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2-hydroxy-3-methoxypropyl)amino]-2,2-dimethylcyclobutan-1-ol is sourced from PubChem (CID 112634064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).