5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one

C14H18N2OS — CID 61334552

IUPAC5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one
SMILESCCc1ccc(C(C)Nc2ccc(=O)n(C)c2)s1
InChIInChI=1S/C14H18N2OS/c1-4-12-6-7-13(18-12)10(2)15-11-5-8-14(17)16(3)9-11/h5-10,15H,4H2,1-3H3
InChIKeyBRUNRYINGPDGGY-UHFFFAOYSA-N
MW262.38 g/mol
LogP3.18
Rot. Bonds4

About 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one

5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one (PubChem CID 61334552) has the molecular formula C14H18N2OS and a molecular weight of 262.38 g/mol. Its IUPAC name is 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one
PubChem CID61334552
Molecular FormulaC14H18N2OS
Molecular Weight262.38 g/mol
Exact Mass262.11
IUPAC Name5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one
SMILESCCc1ccc(C(C)Nc2ccc(=O)n(C)c2)s1
InChIInChI=1S/C14H18N2OS/c1-4-12-6-7-13(18-12)10(2)15-11-5-8-14(17)16(3)9-11/h5-10,15H,4H2,1-3H3
InChIKeyBRUNRYINGPDGGY-UHFFFAOYSA-N
XLogP3.18
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.38
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(5-ethylthiophen-2-yl)methylamino]-1-methylpyridin-2-one
CID 62345735
N-[1-(5-ethylthiophen-2-yl)ethyl]-4-methylsulfonylaniline
CID 61335118
4-[1-(5-ethylthiophen-2-yl)ethylamino]benzoic acid
CID 61333563
N-[1-(5-ethylthiophen-2-yl)ethyl]naphthalen-2-amine
CID 63425907
4-[1-(5-ethylthiophen-2-yl)ethylamino]-N,N-dimethylbenzamide
CID 61335120
2-[4-[1-(5-ethylthiophen-2-yl)ethylamino]phenyl]acetamide
CID 61334963
3-chloro-N-[1-(5-ethylthiophen-2-yl)ethyl]-4-nitroaniline
CID 82864654
1-methyl-5-(2-methylpentan-3-ylamino)pyridin-2-one
CID 60932040
3-chloro-N-[1-(5-ethylthiophen-2-yl)ethyl]-4-methylaniline
CID 55186067
N-[1-(5-ethylthiophen-2-yl)ethyl]-3,4-dimethoxyaniline
CID 61334130
2-[4-[1-(5-ethylthiophen-2-yl)ethylamino]pyrazol-1-yl]-N-methylacetamide
CID 61334554
3-bromo-N-[1-(5-ethylthiophen-2-yl)ethyl]-4-fluoroaniline
CID 104775686

Frequently Asked Questions

What is the IUPAC name of 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one?
The IUPAC name of 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one (CID 61334552) is 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one.
What is the SMILES notation for 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one?
The canonical SMILES for 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one is CCc1ccc(C(C)Nc2ccc(=O)n(C)c2)s1.
What is the InChIKey of 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one?
The InChIKey is BRUNRYINGPDGGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2OS/c1-4-12-6-7-13(18-12)10(2)15-11-5-8-14(17)16(3)9-11/h5-10,15H,4H2,1-3H3.
What are the key properties of 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one?
5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one has a molecular weight of 262.38 g/mol, XLogP of 3.18, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(5-ethylthiophen-2-yl)ethylamino]-1-methylpyridin-2-one is sourced from PubChem (CID 61334552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).