(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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Related Compounds

[4-(aminomethyl)oxan-4-yl]-thiophen-2-ylmethanol
CID 79134716
3-amino-2,2-dimethyl-1-thiophen-2-ylpropan-1-ol
CID 79135544
2-propan-2-ylthiophene
CID 178128598
1-[hydroxy(thiophen-2-yl)methyl]cyclohexan-1-ol
CID 103451819
1-[hydroxy(thiophen-2-yl)methyl]cyclopropane-1-carboxylic acid
CID 116836256
1,2-dithiophen-2-ylethane-1,2-diol
CID 11128014
(1R,2R)-1,2-dithiophen-2-ylethane-1,2-diamine
CID 156789144
(3,4-dimethyl-1-thiophen-2-ylpyrrolidin-3-yl)methanamine
CID 130562606
3-amino-2-(4-propan-2-ylphenyl)-1-thiophen-2-ylpropan-1-ol
CID 65189371
(2-methyloxan-2-yl)-thiophen-2-ylmethanol
CID 80685813
(1-methoxy-4,4-dimethylcyclohexyl)-thiophen-2-ylmethanol
CID 116755748
1-hydroxy-1-thiophen-2-ylpropan-2-one
CID 15048018

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).