N-[(3R)-4-methoxyoxan-3-yl]methanimine

C7H13NO2 — CID 158130238

IUPACN-[(3R)-4-methoxyoxan-3-yl]methanimine
SMILESC=N[C@@H]1COCCC1OC
InChIInChI=1S/C7H13NO2/c1-8-6-5-10-4-3-7(6)9-2/h6-7H,1,3-5H2,2H3/t6-,7?/m1/s1
InChIKeyFSRKMVWWZDWNOU-ULUSZKPHSA-N
MW143.19 g/mol
LogP0.49
Rot. Bonds2

About N-[(3R)-4-methoxyoxan-3-yl]methanimine

N-[(3R)-4-methoxyoxan-3-yl]methanimine (PubChem CID 158130238) has the molecular formula C7H13NO2 and a molecular weight of 143.19 g/mol. Its IUPAC name is N-[(3R)-4-methoxyoxan-3-yl]methanimine.

Molecular Properties

Compound NameN-[(3R)-4-methoxyoxan-3-yl]methanimine
PubChem CID158130238
Molecular FormulaC7H13NO2
Molecular Weight143.19 g/mol
Exact Mass143.09
IUPAC NameN-[(3R)-4-methoxyoxan-3-yl]methanimine
SMILESC=N[C@@H]1COCCC1OC
InChIInChI=1S/C7H13NO2/c1-8-6-5-10-4-3-7(6)9-2/h6-7H,1,3-5H2,2H3/t6-,7?/m1/s1
InChIKeyFSRKMVWWZDWNOU-ULUSZKPHSA-N
XLogP0.49
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

CID 170573296
CID 170573296
(3R,4R)-4-methoxy-N-methyloxan-3-amine;hydrochloride
CID 178190292
4-chloro-3-methoxyoxane
CID 130632423
ethane;3-methoxy-4-methyloxane
CID 143656491
3-methoxy-4-prop-1-en-2-yloxane
CID 163535676
(3S,4R)-3-methoxyoxan-4-amine;hydrochloride
CID 122235837
[(3R,4S)-3-methoxyoxan-4-yl]methanamine
CID 67314237
N-(4-methoxyoxan-3-yl)acetamide
CID 157037977
N-methoxy-N-methyloxolan-3-amine
CID 142607541
1-(3-methoxyoxan-4-yl)-2-methylpropan-1-amine
CID 131101922
N-(2-methoxycyclohexyl)oxolan-3-amine
CID 80717087
1-(3-methoxyoxan-4-yl)propan-1-ol
CID 130723846

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-4-methoxyoxan-3-yl]methanimine?
The IUPAC name of N-[(3R)-4-methoxyoxan-3-yl]methanimine (CID 158130238) is N-[(3R)-4-methoxyoxan-3-yl]methanimine.
What is the SMILES notation for N-[(3R)-4-methoxyoxan-3-yl]methanimine?
The canonical SMILES for N-[(3R)-4-methoxyoxan-3-yl]methanimine is C=N[C@@H]1COCCC1OC.
What is the InChIKey of N-[(3R)-4-methoxyoxan-3-yl]methanimine?
The InChIKey is FSRKMVWWZDWNOU-ULUSZKPHSA-N. The full InChI is InChI=1S/C7H13NO2/c1-8-6-5-10-4-3-7(6)9-2/h6-7H,1,3-5H2,2H3/t6-,7?/m1/s1.
What are the key properties of N-[(3R)-4-methoxyoxan-3-yl]methanimine?
N-[(3R)-4-methoxyoxan-3-yl]methanimine has a molecular weight of 143.19 g/mol, XLogP of 0.49, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-4-methoxyoxan-3-yl]methanimine is sourced from PubChem (CID 158130238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).