4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol

C17H33NO2 — CID 114624346

IUPAC4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol
SMILESCCCNC1CCC(O)(C2CC(C)(C)OC2(C)C)CC1
InChIInChI=1S/C17H33NO2/c1-6-11-18-13-7-9-17(19,10-8-13)14-12-15(2,3)20-16(14,4)5/h13-14,18-19H,6-12H2,1-5H3
InChIKeyNTFTYLNPMYPIOT-UHFFFAOYSA-N
MW283.46 g/mol
LogP3.25
Rot. Bonds4

About 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol

4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol (PubChem CID 114624346) has the molecular formula C17H33NO2 and a molecular weight of 283.46 g/mol. Its IUPAC name is 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol
PubChem CID114624346
Molecular FormulaC17H33NO2
Molecular Weight283.46 g/mol
Exact Mass283.25
IUPAC Name4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol
SMILESCCCNC1CCC(O)(C2CC(C)(C)OC2(C)C)CC1
InChIInChI=1S/C17H33NO2/c1-6-11-18-13-7-9-17(19,10-8-13)14-12-15(2,3)20-16(14,4)5/h13-14,18-19H,6-12H2,1-5H3
InChIKeyNTFTYLNPMYPIOT-UHFFFAOYSA-N
XLogP3.25
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.46
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-propyl-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol
CID 114621893
3,3-dimethyl-N-propylcyclopentan-1-amine
CID 20709207
1-(2,6-dioxaspiro[4.5]decan-9-yl)-4-(propylamino)cyclohexan-1-ol
CID 79907952
3,3,5,5-tetramethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol
CID 114622197
3,3-dimethyl-N-propyl-2-oxaspiro[4.5]decan-8-amine
CID 165487039
N-propyloxan-4-amine
CID 18348908
3-ethyl-N-propyl-1-(2,2,5,5-tetramethyloxolan-3-yl)piperidin-4-amine
CID 114620933
3-cyclohexyl-3-methyl-N-propylcyclopentan-1-amine
CID 116539796
4-(propylamino)-1-(4,4,4-trifluorobutyl)cyclohexan-1-ol
CID 115519605
4-propyl-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexane-1-carboxylic acid
CID 114624336
3-methyl-3-(3-methylbut-3-enyl)-N-propylcyclopentan-1-amine
CID 114477339
3a,7a-dihydroxy-5-(propylamino)-1,3,4,5,6,7-hexahydrobenzimidazole-2-thione
CID 163203057

Frequently Asked Questions

What is the IUPAC name of 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol?
The IUPAC name of 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol (CID 114624346) is 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol?
The canonical SMILES for 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol is CCCNC1CCC(O)(C2CC(C)(C)OC2(C)C)CC1.
What is the InChIKey of 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol?
The InChIKey is NTFTYLNPMYPIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H33NO2/c1-6-11-18-13-7-9-17(19,10-8-13)14-12-15(2,3)20-16(14,4)5/h13-14,18-19H,6-12H2,1-5H3.
What are the key properties of 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol?
4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol has a molecular weight of 283.46 g/mol, XLogP of 3.25, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(propylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 114624346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).