trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine

C5H11NO — CID 131115476

IUPACtrans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine
SMILESCOC[C@@H]1C[C@@H]1N
InChIInChI=1S/C5H11NO/c1-7-3-4-2-5(4)6/h4-5H,2-3,6H2,1H3/t4-,5-/m0/s1
InChIKeyQFUWGKZFJBYYGC-WHFBIAKZSA-N
MW101.15 g/mol
LogP-0.02
Rot. Bonds2

About trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine

trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine (PubChem CID 131115476) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine.

Molecular Properties

Compound Nametrans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine
PubChem CID131115476
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Nametrans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine
SMILESCOC[C@@H]1C[C@@H]1N
InChIInChI=1S/C5H11NO/c1-7-3-4-2-5(4)6/h4-5H,2-3,6H2,1H3/t4-,5-/m0/s1
InChIKeyQFUWGKZFJBYYGC-WHFBIAKZSA-N
XLogP-0.02
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-(methoxymethyl)cyclopentan-1-amine
CID 89358977
(2S)-2-(methoxymethyl)cyclohexan-1-amine
CID 89098977
cis-(1S,2S)-2-(ethoxymethyl)cyclopropan-1-amine;hydrochloride
CID 135324600
1-(methoxymethyl)-2-propylcyclopropane
CID 123484711
4-(methoxymethyl)cyclopent-2-en-1-amine
CID 130330774
4-(methoxymethyl)cyclopentane-1,3-diol
CID 174518927
cis-(2S,4R)-1-methoxy-2-(methoxymethyl)-4-methylcyclopentane
CID 58944665
(1S,2S,4R)-2-(methoxymethyl)-4-methylcyclopentan-1-ol
CID 58944642
1-(methoxymethyl)-2-(trifluoromethoxymethyl)cyclopropane
CID 162607321
(3S,5S)-5-(methoxymethyl)oxolan-3-amine
CID 131220331
2-(methoxymethyl)-6-azabicyclo[3.1.1]heptane
CID 170431705
[(1S,2R)-2-aminocyclopropyl]methyl N,N-dimethylcarbamate
CID 122191908

Frequently Asked Questions

What is the IUPAC name of trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine?
The IUPAC name of trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine (CID 131115476) is trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine.
What is the SMILES notation for trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine?
The canonical SMILES for trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine is COC[C@@H]1C[C@@H]1N.
What is the InChIKey of trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine?
The InChIKey is QFUWGKZFJBYYGC-WHFBIAKZSA-N. The full InChI is InChI=1S/C5H11NO/c1-7-3-4-2-5(4)6/h4-5H,2-3,6H2,1H3/t4-,5-/m0/s1.
What are the key properties of trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine?
trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine has a molecular weight of 101.15 g/mol, XLogP of -0.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1S,2R)-2-(methoxymethyl)cyclopropan-1-amine is sourced from PubChem (CID 131115476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).