trans-(1R,2R)-2-methylcyclopropan-1-amine

C4H9N — CID 12953691

IUPACtrans-(1R,2R)-2-methylcyclopropan-1-amine
SMILESC[C@@H]1C[C@H]1N
InChIInChI=1S/C4H9N/c1-3-2-4(3)5/h3-4H,2,5H2,1H3/t3-,4-/m1/s1
InChIKeyPYTANBUURZFYHD-QWWZWVQMSA-N
MW71.12 g/mol
LogP0.35
Rot. Bonds

About trans-(1R,2R)-2-methylcyclopropan-1-amine

trans-(1R,2R)-2-methylcyclopropan-1-amine (PubChem CID 12953691) has the molecular formula C4H9N and a molecular weight of 71.12 g/mol. Its IUPAC name is trans-(1R,2R)-2-methylcyclopropan-1-amine.

Molecular Properties

Compound Nametrans-(1R,2R)-2-methylcyclopropan-1-amine
PubChem CID12953691
Molecular FormulaC4H9N
Molecular Weight71.12 g/mol
Exact Mass71.07
IUPAC Nametrans-(1R,2R)-2-methylcyclopropan-1-amine
SMILESC[C@@H]1C[C@H]1N
InChIInChI=1S/C4H9N/c1-3-2-4(3)5/h3-4H,2,5H2,1H3/t3-,4-/m1/s1
InChIKeyPYTANBUURZFYHD-QWWZWVQMSA-N
XLogP0.35
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50071.12
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of trans-(1R,2R)-2-methylcyclopropan-1-amine?
The IUPAC name of trans-(1R,2R)-2-methylcyclopropan-1-amine (CID 12953691) is trans-(1R,2R)-2-methylcyclopropan-1-amine.
What is the SMILES notation for trans-(1R,2R)-2-methylcyclopropan-1-amine?
The canonical SMILES for trans-(1R,2R)-2-methylcyclopropan-1-amine is C[C@@H]1C[C@H]1N.
What is the InChIKey of trans-(1R,2R)-2-methylcyclopropan-1-amine?
The InChIKey is PYTANBUURZFYHD-QWWZWVQMSA-N. The full InChI is InChI=1S/C4H9N/c1-3-2-4(3)5/h3-4H,2,5H2,1H3/t3-,4-/m1/s1.
What are the key properties of trans-(1R,2R)-2-methylcyclopropan-1-amine?
trans-(1R,2R)-2-methylcyclopropan-1-amine has a molecular weight of 71.12 g/mol, XLogP of 0.35, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-(1R,2R)-2-methylcyclopropan-1-amine is sourced from PubChem (CID 12953691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).