2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine

C10H14ClNOS — CID 130643756

IUPAC2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine
SMILESClc1sccc1NCCC1CCOC1
InChIInChI=1S/C10H14ClNOS/c11-10-9(3-6-14-10)12-4-1-8-2-5-13-7-8/h3,6,8,12H,1-2,4-5,7H2
InChIKeyGKNBDQLRGHFSBD-UHFFFAOYSA-N
MW231.75 g/mol
LogP3.24
Rot. Bonds4

About 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine

2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine (PubChem CID 130643756) has the molecular formula C10H14ClNOS and a molecular weight of 231.75 g/mol. Its IUPAC name is 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine.

Molecular Properties

Compound Name2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine
PubChem CID130643756
Molecular FormulaC10H14ClNOS
Molecular Weight231.75 g/mol
Exact Mass231.05
IUPAC Name2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine
SMILESClc1sccc1NCCC1CCOC1
InChIInChI=1S/C10H14ClNOS/c11-10-9(3-6-14-10)12-4-1-8-2-5-13-7-8/h3,6,8,12H,1-2,4-5,7H2
InChIKeyGKNBDQLRGHFSBD-UHFFFAOYSA-N
XLogP3.24
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.75
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-N-[2-(oxolan-3-yl)ethyl]-1,3-benzothiazole-4,5-diamine
CID 114129613
N-(dithiophen-2-ylmethyl)-2-(oxolan-3-yl)ethanamine
CID 102672384
N-[(5-chloro-1,3-thiazol-2-yl)methyl]-2-(oxolan-3-yl)ethanamine
CID 104879629
3,5-dichloro-2-N-methyl-6-N-[2-(oxolan-3-yl)ethyl]pyridine-2,6-diamine
CID 114131325
2-methyl-N-[2-(oxolan-3-yl)ethyl]-1-thiophen-2-ylpropan-1-amine
CID 104537883
2-methyl-N-[2-(oxolan-3-yl)ethyl]pyrazol-3-amine
CID 130617330
5-chloro-N-[2-(oxolan-3-yl)ethyl]thiophene-2-carboxamide
CID 91776294
3,5-difluoro-1-N-[2-(oxolan-3-yl)ethyl]benzene-1,2-diamine
CID 114129599
N-[2-(oxolan-3-yl)ethyl]-2,3-dihydro-1H-inden-2-amine
CID 113424537
2-chloro-N-(oxolan-3-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 103321534
N-[1-(3-chlorothiophen-2-yl)-2-(oxolan-3-yl)ethyl]propan-1-amine
CID 107360148
6-fluoro-N-[2-(oxolan-3-yl)ethyl]-1,3-benzothiazol-2-amine
CID 114131519

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine?
The IUPAC name of 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine (CID 130643756) is 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine.
What is the SMILES notation for 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine?
The canonical SMILES for 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine is Clc1sccc1NCCC1CCOC1.
What is the InChIKey of 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine?
The InChIKey is GKNBDQLRGHFSBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14ClNOS/c11-10-9(3-6-14-10)12-4-1-8-2-5-13-7-8/h3,6,8,12H,1-2,4-5,7H2.
What are the key properties of 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine?
2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine has a molecular weight of 231.75 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(oxolan-3-yl)ethyl]thiophen-3-amine is sourced from PubChem (CID 130643756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).