(2-propyloxolan-3-yl)methanamine

C8H17NO — CID 79368036

IUPAC(2-propyloxolan-3-yl)methanamine
SMILESCCCC1OCCC1CN
InChIInChI=1S/C8H17NO/c1-2-3-8-7(6-9)4-5-10-8/h7-8H,2-6,9H2,1H3
InChIKeyZOLGXUFZJZJYIC-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.15
Rot. Bonds3

About (2-propyloxolan-3-yl)methanamine

(2-propyloxolan-3-yl)methanamine (PubChem CID 79368036) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is (2-propyloxolan-3-yl)methanamine.

Molecular Properties

Compound Name(2-propyloxolan-3-yl)methanamine
PubChem CID79368036
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name(2-propyloxolan-3-yl)methanamine
SMILESCCCC1OCCC1CN
InChIInChI=1S/C8H17NO/c1-2-3-8-7(6-9)4-5-10-8/h7-8H,2-6,9H2,1H3
InChIKeyZOLGXUFZJZJYIC-UHFFFAOYSA-N
XLogP1.15
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-fluoro-2-propyloxolane
CID 156747497
3-chloro-2-propyloxolane
CID 13494559
2-butyloxolan-3-amine
CID 79365227
3-(chloromethyl)-2-hexyloxolane
CID 79373695
[(1S,2S)-2-propylcyclopentyl]methanamine
CID 124512847
(2-benzyloxolan-3-yl)methanamine
CID 79368410
(2S,3S)-2-ethyloxolan-3-amine
CID 124511863
(2R,3R)-2-(aminomethyl)-N,N-diethyloxolan-3-amine
CID 165491409
[(2R,3S)-3-methyloxolan-2-yl]methanamine;hydrochloride
CID 171921112
(2R,3R)-2-(2-bromoethyl)-3-propyl-1,4-dioxane
CID 97304593
[(2S,3R)-2-prop-1-en-2-yloxolan-3-yl]methanamine
CID 99963912
(3-ethyloxolan-2-yl)methanol
CID 139662526

Frequently Asked Questions

What is the IUPAC name of (2-propyloxolan-3-yl)methanamine?
The IUPAC name of (2-propyloxolan-3-yl)methanamine (CID 79368036) is (2-propyloxolan-3-yl)methanamine.
What is the SMILES notation for (2-propyloxolan-3-yl)methanamine?
The canonical SMILES for (2-propyloxolan-3-yl)methanamine is CCCC1OCCC1CN.
What is the InChIKey of (2-propyloxolan-3-yl)methanamine?
The InChIKey is ZOLGXUFZJZJYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-2-3-8-7(6-9)4-5-10-8/h7-8H,2-6,9H2,1H3.
What are the key properties of (2-propyloxolan-3-yl)methanamine?
(2-propyloxolan-3-yl)methanamine has a molecular weight of 143.23 g/mol, XLogP of 1.15, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propyloxolan-3-yl)methanamine is sourced from PubChem (CID 79368036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).