1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine

C11H23NO — CID 116524133

IUPAC1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine
SMILESCCNC(C)CC1CCC(C)(C)O1
InChIInChI=1S/C11H23NO/c1-5-12-9(2)8-10-6-7-11(3,4)13-10/h9-10,12H,5-8H2,1-4H3
InChIKeyRWHFQRCSDCAHHP-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.33
Rot. Bonds4

About 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine

1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine (PubChem CID 116524133) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine.

Molecular Properties

Compound Name1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine
PubChem CID116524133
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine
SMILESCCNC(C)CC1CCC(C)(C)O1
InChIInChI=1S/C11H23NO/c1-5-12-9(2)8-10-6-7-11(3,4)13-10/h9-10,12H,5-8H2,1-4H3
InChIKeyRWHFQRCSDCAHHP-UHFFFAOYSA-N
XLogP2.33
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(5,5-dimethyloxolan-2-yl)methyl]-N-ethyl-3-methylbutan-1-amine
CID 116523574
5-(3-chloro-2-methylpropyl)-2,2-dimethyloxolane
CID 116525177
1-(5,5-dimethyloxolan-2-yl)butan-2-amine
CID 116524943
4-(5,5-dimethyloxolan-2-yl)-N-propylbutan-2-amine
CID 116522567
N-[(5,5-dimethyloxolan-2-yl)methyl]-1-ethoxypropan-2-amine
CID 116521359
2-[(5,5-dimethyloxolan-2-yl)methyl]-N,3-dimethylbutan-1-amine
CID 116523573
N-ethyl-4-methyl-5-(1-oxaspiro[4.4]nonan-2-yl)pentan-2-amine
CID 102901359
N-[(5,5-dimethyloxolan-2-yl)methyl]octan-2-amine
CID 116521320
4-(5,5-dimethyloxolan-2-yl)-N-methylbutan-2-amine
CID 116522565
N-[(5,5-dimethyloxolan-2-yl)methyl]-1-methoxypropan-2-amine
CID 116521074
2-[(5,5-dimethyloxolan-2-yl)methylamino]-N-ethylpropanamide
CID 116521319
1-(5,5-dimethyloxolan-2-yl)-3-(propylamino)propan-2-ol
CID 116525058

Frequently Asked Questions

What is the IUPAC name of 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine?
The IUPAC name of 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine (CID 116524133) is 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine.
What is the SMILES notation for 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine?
The canonical SMILES for 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine is CCNC(C)CC1CCC(C)(C)O1.
What is the InChIKey of 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine?
The InChIKey is RWHFQRCSDCAHHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-5-12-9(2)8-10-6-7-11(3,4)13-10/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine?
1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine has a molecular weight of 185.31 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,5-dimethyloxolan-2-yl)-N-ethylpropan-2-amine is sourced from PubChem (CID 116524133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).