(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol

C10H15NOS — CID 99962438

IUPAC(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol
SMILESC[C@H]1C[C@]1(CN)[C@@H](O)c1cccs1
InChIInChI=1S/C10H15NOS/c1-7-5-10(7,6-11)9(12)8-3-2-4-13-8/h2-4,7,9,12H,5-6,11H2,1H3/t7-,9-,10+/m0/s1
InChIKeyYEPZMFNTPLXJLU-UJNFCWOMSA-N
MW197.30 g/mol
LogP1.77
Rot. Bonds3

About (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol

(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol (PubChem CID 99962438) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol
PubChem CID99962438
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol
SMILESC[C@H]1C[C@]1(CN)[C@@H](O)c1cccs1
InChIInChI=1S/C10H15NOS/c1-7-5-10(7,6-11)9(12)8-3-2-4-13-8/h2-4,7,9,12H,5-6,11H2,1H3/t7-,9-,10+/m0/s1
InChIKeyYEPZMFNTPLXJLU-UJNFCWOMSA-N
XLogP1.77
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol?
The IUPAC name of (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol (CID 99962438) is (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol.
What is the SMILES notation for (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol?
The canonical SMILES for (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol is C[C@H]1C[C@]1(CN)[C@@H](O)c1cccs1.
What is the InChIKey of (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol?
The InChIKey is YEPZMFNTPLXJLU-UJNFCWOMSA-N. The full InChI is InChI=1S/C10H15NOS/c1-7-5-10(7,6-11)9(12)8-3-2-4-13-8/h2-4,7,9,12H,5-6,11H2,1H3/t7-,9-,10+/m0/s1.
What are the key properties of (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol?
(R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol has a molecular weight of 197.30 g/mol, XLogP of 1.77, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-[(1S,2S)-1-(aminomethyl)-2-methylcyclopropyl]-thiophen-2-ylmethanol is sourced from PubChem (CID 99962438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).