(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide

C10H15ClN2OS — CID 103932076

IUPAC(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide
SMILESCNC(=O)[C@@H](C)NC(C)c1ccc(Cl)s1
InChIInChI=1S/C10H15ClN2OS/c1-6(8-4-5-9(11)15-8)13-7(2)10(14)12-3/h4-7,13H,1-3H3,(H,12,14)/t6?,7-/m1/s1
InChIKeyCNAZADWBSUOVHR-COBSHVIPSA-N
MW246.76 g/mol
LogP2.19
Rot. Bonds4

About (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide

(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide (PubChem CID 103932076) has the molecular formula C10H15ClN2OS and a molecular weight of 246.76 g/mol. Its IUPAC name is (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide.

Molecular Properties

Compound Name(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide
PubChem CID103932076
Molecular FormulaC10H15ClN2OS
Molecular Weight246.76 g/mol
Exact Mass246.06
IUPAC Name(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide
SMILESCNC(=O)[C@@H](C)NC(C)c1ccc(Cl)s1
InChIInChI=1S/C10H15ClN2OS/c1-6(8-4-5-9(11)15-8)13-7(2)10(14)12-3/h4-7,13H,1-3H3,(H,12,14)/t6?,7-/m1/s1
InChIKeyCNAZADWBSUOVHR-COBSHVIPSA-N
XLogP2.19
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.76
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-propylpropanamide
CID 43435789
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517
2-[1-(5-ethylthiophen-2-yl)ethylamino]-N-methylpropanamide
CID 61464605
2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-(3-methoxypropyl)propanamide
CID 61469359
2-amino-2-(5-chlorothiophen-2-yl)-N-methylacetamide
CID 116850381
N-methyl-2-[[(1S)-1-thiophen-2-ylethyl]amino]propanamide
CID 81408171
2-[1-(5-chlorothiophen-2-yl)ethylamino]-3-methylbutanamide
CID 103875860
N-[(1R)-1-(5-chlorothiophen-2-yl)ethyl]acetamide
CID 131207227
2-bromo-N-[1-(5-chlorothiophen-2-yl)ethyl]propanamide
CID 107903709
methyl N-[1-(5-chlorothiophen-2-yl)ethyl]carbamate
CID 115579886
3-(5-chlorothiophen-2-yl)-N,4-dimethylpentanamide
CID 82085991
(2R)-2-[[(1R)-1-(2-chlorophenyl)ethyl]amino]-N-methylpropanamide
CID 9410224

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide?
The IUPAC name of (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide (CID 103932076) is (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide.
What is the SMILES notation for (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide?
The canonical SMILES for (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide is CNC(=O)[C@@H](C)NC(C)c1ccc(Cl)s1.
What is the InChIKey of (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide?
The InChIKey is CNAZADWBSUOVHR-COBSHVIPSA-N. The full InChI is InChI=1S/C10H15ClN2OS/c1-6(8-4-5-9(11)15-8)13-7(2)10(14)12-3/h4-7,13H,1-3H3,(H,12,14)/t6?,7-/m1/s1.
What are the key properties of (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide?
(2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide has a molecular weight of 246.76 g/mol, XLogP of 2.19, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[1-(5-chlorothiophen-2-yl)ethylamino]-N-methylpropanamide is sourced from PubChem (CID 103932076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).