2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide

C12H17ClN2OS — CID 64676702

IUPAC2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide
SMILESNC1(CC(=O)NCc2ccc(Cl)s2)CCCC1
InChIInChI=1S/C12H17ClN2OS/c13-10-4-3-9(17-10)8-15-11(16)7-12(14)5-1-2-6-12/h3-4H,1-2,5-8,14H2,(H,15,16)
InChIKeyUUFVDYPXSZYLJQ-UHFFFAOYSA-N
MW272.80 g/mol
LogP2.68
Rot. Bonds4

About 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide

2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide (PubChem CID 64676702) has the molecular formula C12H17ClN2OS and a molecular weight of 272.80 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide
PubChem CID64676702
Molecular FormulaC12H17ClN2OS
Molecular Weight272.80 g/mol
Exact Mass272.08
IUPAC Name2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide
SMILESNC1(CC(=O)NCc2ccc(Cl)s2)CCCC1
InChIInChI=1S/C12H17ClN2OS/c13-10-4-3-9(17-10)8-15-11(16)7-12(14)5-1-2-6-12/h3-4H,1-2,5-8,14H2,(H,15,16)
InChIKeyUUFVDYPXSZYLJQ-UHFFFAOYSA-N
XLogP2.68
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.80
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-[(5-chlorothiophen-2-yl)methyl]cyclohexane-1-carboxamide
CID 115437904
2-chloro-N-[(5-chlorothiophen-2-yl)methyl]acetamide
CID 50988904
2-[1-[(5-chlorothiophen-2-yl)methylcarbamoylamino]cyclohexyl]acetic acid
CID 64701883
N-[2-(5-chlorothiophen-2-yl)ethyl]-2-(1-hydroxycyclopentyl)acetamide
CID 111536745
2-(1-aminocyclopentyl)-N-[(4-bromothiophen-2-yl)methyl]acetamide
CID 64676894
2-(1-aminocyclopentyl)-N-[(3-chlorophenyl)methyl]acetamide
CID 64684380
1-[(5-chlorothiophen-2-yl)methylcarbamoylamino]cycloheptane-1-carboxylic acid
CID 29051217
2-[1-[2-[2-(5-chlorothiophen-2-yl)ethylamino]-2-oxoethyl]cyclopentyl]acetic acid
CID 106032552
1-[(5-chlorothiophen-2-yl)methyl]-3-methoxyurea
CID 47229061
N-[[1-(aminomethyl)cyclopentyl]methyl]-1-(5-chlorothiophen-2-yl)methanamine
CID 115435554
N-[(5-chlorothiophen-2-yl)methyl]-3-methylpiperidine-3-carboxamide;hydrochloride
CID 119944666
2-(1-aminocyclopentyl)-N-[(2-methylpyrimidin-4-yl)methyl]acetamide
CID 64678565

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide (CID 64676702) is 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide is NC1(CC(=O)NCc2ccc(Cl)s2)CCCC1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide?
The InChIKey is UUFVDYPXSZYLJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17ClN2OS/c13-10-4-3-9(17-10)8-15-11(16)7-12(14)5-1-2-6-12/h3-4H,1-2,5-8,14H2,(H,15,16).
What are the key properties of 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide?
2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide has a molecular weight of 272.80 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-[(5-chlorothiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 64676702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).