[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol

C5H11NO — CID 53302237

IUPAC[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol
SMILESNC[C@H]1C[C@@H]1CO
InChIInChI=1S/C5H11NO/c6-2-4-1-5(4)3-7/h4-5,7H,1-3,6H2/t4-,5-/m1/s1
InChIKeyCVFJLNNLCHRICT-RFZPGFLSSA-N
MW101.15 g/mol
LogP-0.43
Rot. Bonds2

About [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol

[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol (PubChem CID 53302237) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol.

Molecular Properties

Compound Name[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol
PubChem CID53302237
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol
SMILESNC[C@H]1C[C@@H]1CO
InChIInChI=1S/C5H11NO/c6-2-4-1-5(4)3-7/h4-5,7H,1-3,6H2/t4-,5-/m1/s1
InChIKeyCVFJLNNLCHRICT-RFZPGFLSSA-N
XLogP-0.43
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol?
The IUPAC name of [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol (CID 53302237) is [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol.
What is the SMILES notation for [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol?
The canonical SMILES for [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol is NC[C@H]1C[C@@H]1CO.
What is the InChIKey of [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol?
The InChIKey is CVFJLNNLCHRICT-RFZPGFLSSA-N. The full InChI is InChI=1S/C5H11NO/c6-2-4-1-5(4)3-7/h4-5,7H,1-3,6H2/t4-,5-/m1/s1.
What are the key properties of [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol?
[(1S,2S)-2-(aminomethyl)cyclopropyl]methanol has a molecular weight of 101.15 g/mol, XLogP of -0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1S,2S)-2-(aminomethyl)cyclopropyl]methanol is sourced from PubChem (CID 53302237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).