2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol

C10H15NOS — CID 61054631

IUPAC2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol
SMILESOCC(NCC1CC1)c1ccsc1
InChIInChI=1S/C10H15NOS/c12-6-10(9-3-4-13-7-9)11-5-8-1-2-8/h3-4,7-8,10-12H,1-2,5-6H2
InChIKeyWLVKIDWNXHRWFY-UHFFFAOYSA-N
MW197.30 g/mol
LogP1.78
Rot. Bonds5

About 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol

2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol (PubChem CID 61054631) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol
PubChem CID61054631
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol
SMILESOCC(NCC1CC1)c1ccsc1
InChIInChI=1S/C10H15NOS/c12-6-10(9-3-4-13-7-9)11-5-8-1-2-8/h3-4,7-8,10-12H,1-2,5-6H2
InChIKeyWLVKIDWNXHRWFY-UHFFFAOYSA-N
XLogP1.78
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(cyclopropylmethylamino)-2-phenylethanol
CID 93471769
2-(cyclopropylmethylamino)-2-thiophen-3-ylacetic acid
CID 61002802
2-(cyclopropylmethylamino)-2-(4-methylphenyl)ethanol
CID 61056447
2-(cyclopropylmethylamino)-2-(3,4,5-trimethoxyphenyl)ethanol
CID 61054231
4-[1-(cyclopropylmethylamino)-2-hydroxyethyl]-2,6-dimethylphenol
CID 61055235
(2S)-2-[(3-chlorothiophen-2-yl)methylamino]-2-thiophen-3-ylethanol
CID 100697818
2-(cyclopropylmethylamino)-2-[4-(trifluoromethoxy)phenyl]ethanol
CID 61055835
2-(4-bromo-3-methylphenyl)-2-(cyclopropylmethylamino)ethanol
CID 66481065
2-anilino-2-thiophen-3-ylethanol
CID 61046971
2-(cyclopropylmethylamino)-2-(1-methylpyrazol-4-yl)ethanol
CID 61055041
1-cyclopropyl-2-(1-thiophen-3-ylethylamino)ethanol
CID 63295027
N-(cyclopentylmethyl)-2-thiophen-3-ylpropan-1-amine
CID 115907862

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol?
The IUPAC name of 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol (CID 61054631) is 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol.
What is the SMILES notation for 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol?
The canonical SMILES for 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol is OCC(NCC1CC1)c1ccsc1.
What is the InChIKey of 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol?
The InChIKey is WLVKIDWNXHRWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c12-6-10(9-3-4-13-7-9)11-5-8-1-2-8/h3-4,7-8,10-12H,1-2,5-6H2.
What are the key properties of 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol?
2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol has a molecular weight of 197.30 g/mol, XLogP of 1.78, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-2-thiophen-3-ylethanol is sourced from PubChem (CID 61054631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).