4-amino-N-(5-chlorothiophen-2-yl)pentanamide

C9H13ClN2OS — CID 115156541

IUPAC4-amino-N-(5-chlorothiophen-2-yl)pentanamide
SMILESCC(N)CCC(=O)Nc1ccc(Cl)s1
InChIInChI=1S/C9H13ClN2OS/c1-6(11)2-4-8(13)12-9-5-3-7(10)14-9/h3,5-6H,2,4,11H2,1H3,(H,12,13)
InChIKeyOSZYUXIFAHXKCC-UHFFFAOYSA-N
MW232.74 g/mol
LogP2.47
Rot. Bonds4

About 4-amino-N-(5-chlorothiophen-2-yl)pentanamide

4-amino-N-(5-chlorothiophen-2-yl)pentanamide (PubChem CID 115156541) has the molecular formula C9H13ClN2OS and a molecular weight of 232.74 g/mol. Its IUPAC name is 4-amino-N-(5-chlorothiophen-2-yl)pentanamide.

Molecular Properties

Compound Name4-amino-N-(5-chlorothiophen-2-yl)pentanamide
PubChem CID115156541
Molecular FormulaC9H13ClN2OS
Molecular Weight232.74 g/mol
Exact Mass232.04
IUPAC Name4-amino-N-(5-chlorothiophen-2-yl)pentanamide
SMILESCC(N)CCC(=O)Nc1ccc(Cl)s1
InChIInChI=1S/C9H13ClN2OS/c1-6(11)2-4-8(13)12-9-5-3-7(10)14-9/h3,5-6H,2,4,11H2,1H3,(H,12,13)
InChIKeyOSZYUXIFAHXKCC-UHFFFAOYSA-N
XLogP2.47
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.74
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-chlorothiophen-2-yl)acetamide
CID 11492022
1-(5-Chlorothiophen-2-yl)-3-(methylamino)pyrrolidin-2-one
CID 53767482
1-(5-Chlorothiophen-2-yl)-5-ethylpyrrolidin-2-one
CID 67953783
1-(5-Chlorothiophen-2-yl)-5-methylpyrrolidin-2-one
CID 117884742
N-(5-chlorothiophen-2-yl)-N-(2,6-dioxopiperidin-3-yl)pentanamide
CID 156408855
3-[(5-Chlorothiophen-2-yl)-methylamino]piperidine-2,6-dione
CID 175831682
Propanamide, N-(5-chloro-2-thienyl)-
CID 55250531
N-(5-chlorothiophen-2-yl)-2-(methylamino)acetamide
CID 83532442
2-amino-N-thiophen-2-ylpentanamide
CID 83618453
1-(5-Chlorothiophen-2-yl)-3-methylpiperazin-2-one
CID 83711932
1-(5-Chlorothiophen-2-yl)-4-(methylamino)pyrrolidin-2-one
CID 84139510
1-(5-Chlorothiophen-2-yl)-4-(ethylamino)pyrrolidin-2-one
CID 84158387

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-chlorothiophen-2-yl)pentanamide?
The IUPAC name of 4-amino-N-(5-chlorothiophen-2-yl)pentanamide (CID 115156541) is 4-amino-N-(5-chlorothiophen-2-yl)pentanamide.
What is the SMILES notation for 4-amino-N-(5-chlorothiophen-2-yl)pentanamide?
The canonical SMILES for 4-amino-N-(5-chlorothiophen-2-yl)pentanamide is CC(N)CCC(=O)Nc1ccc(Cl)s1.
What is the InChIKey of 4-amino-N-(5-chlorothiophen-2-yl)pentanamide?
The InChIKey is OSZYUXIFAHXKCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN2OS/c1-6(11)2-4-8(13)12-9-5-3-7(10)14-9/h3,5-6H,2,4,11H2,1H3,(H,12,13).
What are the key properties of 4-amino-N-(5-chlorothiophen-2-yl)pentanamide?
4-amino-N-(5-chlorothiophen-2-yl)pentanamide has a molecular weight of 232.74 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-chlorothiophen-2-yl)pentanamide is sourced from PubChem (CID 115156541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).