3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine

C12H25NO — CID 105028497

IUPAC3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine
SMILESCCC(CC)CC(N)C1OCCC1C
InChIInChI=1S/C12H25NO/c1-4-10(5-2)8-11(13)12-9(3)6-7-14-12/h9-12H,4-8,13H2,1-3H3
InChIKeyIHSMULOJCMCIPB-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.57
Rot. Bonds5

About 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine

3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine (PubChem CID 105028497) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine
PubChem CID105028497
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine
SMILESCCC(CC)CC(N)C1OCCC1C
InChIInChI=1S/C12H25NO/c1-4-10(5-2)8-11(13)12-9(3)6-7-14-12/h9-12H,4-8,13H2,1-3H3
InChIKeyIHSMULOJCMCIPB-UHFFFAOYSA-N
XLogP2.57
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3S,4S,5R)-4-fluoro-5-(2-methylpropyl)-2-propan-2-yloxolan-3-amine
CID 176612976
1-(5-Methyl-2-tetra-hydrofurfuryl)-2-aminocyclopentane
CID 13025932
4,4,4-Trifluoro-1-(2-methyloxolan-2-yl)butan-1-amine
CID 80174573
4,4,4-Trifluoro-1-(3-methyloxolan-2-yl)butan-1-amine
CID 104992975
5,5,5-Trifluoro-1-(3-methyloxolan-2-yl)pentan-1-amine
CID 105024347
1-(3,3-Difluorocyclopentyl)-3-ethoxyhexan-2-amine
CID 114224940
2-(3,3-Difluorocyclohexyl)-1-(5-methyloxolan-2-yl)ethanamine
CID 114225874
5,5,5-Trifluoro-1-(2-methyloxolan-2-yl)pentan-1-amine
CID 115517425
2-(2,2-Difluorocyclopropyl)-1-(5-methyloxolan-2-yl)ethan-1-amine
CID 164651249
2-(2,2-Difluoro-1-methylcyclopropyl)-1-(oxolan-2-yl)ethan-1-amine
CID 164659616
(5-Cyclohexyloxolan-2-yl)methanamine
CID 11636934
5-Methyl-1-(oxolan-2-yl)hexan-3-amine
CID 13029349

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine?
The IUPAC name of 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine (CID 105028497) is 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine.
What is the SMILES notation for 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine?
The canonical SMILES for 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine is CCC(CC)CC(N)C1OCCC1C.
What is the InChIKey of 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine?
The InChIKey is IHSMULOJCMCIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-4-10(5-2)8-11(13)12-9(3)6-7-14-12/h9-12H,4-8,13H2,1-3H3.
What are the key properties of 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine?
3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(3-methyloxolan-2-yl)pentan-1-amine is sourced from PubChem (CID 105028497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).