(3S)-2-methoxy-N-propyloxolan-3-amine

C8H17NO2 — CID 89220326

IUPAC(3S)-2-methoxy-N-propyloxolan-3-amine
SMILESCCCN[C@H]1CCOC1OC
InChIInChI=1S/C8H17NO2/c1-3-5-9-7-4-6-11-8(7)10-2/h7-9H,3-6H2,1-2H3/t7-,8?/m0/s1
InChIKeyUHFWIZMERXVSGO-JAMMHHFISA-N
MW159.23 g/mol
LogP0.75
Rot. Bonds4

About (3S)-2-methoxy-N-propyloxolan-3-amine

(3S)-2-methoxy-N-propyloxolan-3-amine (PubChem CID 89220326) has the molecular formula C8H17NO2 and a molecular weight of 159.23 g/mol. Its IUPAC name is (3S)-2-methoxy-N-propyloxolan-3-amine.

Molecular Properties

Compound Name(3S)-2-methoxy-N-propyloxolan-3-amine
PubChem CID89220326
Molecular FormulaC8H17NO2
Molecular Weight159.23 g/mol
Exact Mass159.13
IUPAC Name(3S)-2-methoxy-N-propyloxolan-3-amine
SMILESCCCN[C@H]1CCOC1OC
InChIInChI=1S/C8H17NO2/c1-3-5-9-7-4-6-11-8(7)10-2/h7-9H,3-6H2,1-2H3/t7-,8?/m0/s1
InChIKeyUHFWIZMERXVSGO-JAMMHHFISA-N
XLogP0.75
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-propyloxolan-3-amine;hydrochloride
CID 146154013
CID 59732107
CID 59732107
(2S,3R)-3-ethyl-2-methoxyoxolane
CID 142222546
3-(3-methoxy-3-methylbutyl)-N-propyloxan-4-amine
CID 106469455
3-(3-methoxypyrrolidin-1-yl)-N-propyloxan-4-amine
CID 103532098
(2S,3R)-2-methyl-N-pentyloxolan-3-amine
CID 97358110
(3R)-2-methoxyoxolan-3-amine
CID 121422095
[(2R,3R)-2-methoxyoxolan-3-yl]methanol
CID 130877552
2-methyl-N-(3-propoxypropyl)oxolan-3-amine
CID 82940328
N-butyl-2-cyclopropyloxolan-3-amine
CID 103580713
(2S,3S)-2-methoxyoxolane-3-carboxylic acid
CID 97303923
N-propyloxan-4-amine
CID 18348908

Frequently Asked Questions

What is the IUPAC name of (3S)-2-methoxy-N-propyloxolan-3-amine?
The IUPAC name of (3S)-2-methoxy-N-propyloxolan-3-amine (CID 89220326) is (3S)-2-methoxy-N-propyloxolan-3-amine.
What is the SMILES notation for (3S)-2-methoxy-N-propyloxolan-3-amine?
The canonical SMILES for (3S)-2-methoxy-N-propyloxolan-3-amine is CCCN[C@H]1CCOC1OC.
What is the InChIKey of (3S)-2-methoxy-N-propyloxolan-3-amine?
The InChIKey is UHFWIZMERXVSGO-JAMMHHFISA-N. The full InChI is InChI=1S/C8H17NO2/c1-3-5-9-7-4-6-11-8(7)10-2/h7-9H,3-6H2,1-2H3/t7-,8?/m0/s1.
What are the key properties of (3S)-2-methoxy-N-propyloxolan-3-amine?
(3S)-2-methoxy-N-propyloxolan-3-amine has a molecular weight of 159.23 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-2-methoxy-N-propyloxolan-3-amine is sourced from PubChem (CID 89220326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).