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

C5H11NO — CID 45116619

IUPACtrans-(1R,2S)-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-/m1/s1
InChIKeyQFUWGKZFJBYYGC-RFZPGFLSSA-N
MW101.15 g/mol
LogP-0.02
Rot. Bonds2

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

trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine (PubChem CID 45116619) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine.

Molecular Properties

Compound Nametrans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine
PubChem CID45116619
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Nametrans-(1R,2S)-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-/m1/s1
InChIKeyQFUWGKZFJBYYGC-RFZPGFLSSA-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

(1S,2S)-2-(methoxymethyl)cyclopropan-1-amine hydrochloride
CID 141518284
(1S,2S)-2-(methoxymethyl)cyclopropan-1-amine
CID 135323783
4-Methoxy-3-methylbutan-2-amine
CID 64121420
2-(Methoxymethyl)cyclopropan-1-amine
CID 75094614
2-(Ethoxymethyl)cyclopropan-1-amine
CID 117273481
cis-(1S,2S)-2-(ethoxymethyl)cyclopropan-1-amine
CID 126676036
cis-(1R,2R)-2-(ethoxymethyl)cyclopropan-1-amine
CID 126676791
Cyclopropyl(methoxy)methanamine
CID 130390412
(2R)-4-methoxy-3-methylbutan-2-amine
CID 134348590
2-(Methoxymethyl)cyclopropan-1-amine hydrochloride
CID 135323709
cis-(1S,2S)-2-(ethoxymethyl)cyclopropan-1-amine;hydrochloride
CID 135324600
rac-(1R,2R)-2-(methoxymethyl)cyclopropan-1-amine
CID 135324741

Frequently Asked Questions

What is the IUPAC name of trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine?
The IUPAC name of trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine (CID 45116619) is trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine.
What is the SMILES notation for trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine?
The canonical SMILES for trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine is COC[C@H]1C[C@H]1N.
What is the InChIKey of trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine?
The InChIKey is QFUWGKZFJBYYGC-RFZPGFLSSA-N. The full InChI is InChI=1S/C5H11NO/c1-7-3-4-2-5(4)6/h4-5H,2-3,6H2,1H3/t4-,5-/m1/s1.
What are the key properties of trans-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine?
trans-(1R,2S)-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-(1R,2S)-2-(methoxymethyl)cyclopropan-1-amine is sourced from PubChem (CID 45116619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).