2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide

C16H26N2OS — CID 78987130

IUPAC2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
SMILESCC(C)(C)NCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C16H26N2OS/c1-16(2,3)17-11-14(19)18-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15,17H,4-5,7-8,11H2,1-3H3,(H,18,19)
InChIKeyGDMKGJXSCRSUAZ-UHFFFAOYSA-N
MW294.46 g/mol
LogP3.48
Rot. Bonds5

About 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide

2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide (PubChem CID 78987130) has the molecular formula C16H26N2OS and a molecular weight of 294.46 g/mol. Its IUPAC name is 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
PubChem CID78987130
Molecular FormulaC16H26N2OS
Molecular Weight294.46 g/mol
Exact Mass294.18
IUPAC Name2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
SMILESCC(C)(C)NCC(=O)NC(c1cccs1)C1CCCC1
InChIInChI=1S/C16H26N2OS/c1-16(2,3)17-11-14(19)18-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15,17H,4-5,7-8,11H2,1-3H3,(H,18,19)
InChIKeyGDMKGJXSCRSUAZ-UHFFFAOYSA-N
XLogP3.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.46
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopentylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide
CID 60847966
N-[2-[[cyclopentyl(thiophen-2-yl)methyl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 42960858
1-[(R)-cyclopentyl(thiophen-2-yl)methyl]-3-methylurea
CID 94152755
2-(tert-butylamino)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 81408985
N-[cyclopentyl(thiophen-2-yl)methyl]-2-(4-methoxyphenyl)acetamide
CID 42960691
N-tert-butyl-2-[[cyclopropyl(thiophen-2-yl)methyl]amino]acetamide
CID 113220254
N-[(R)-cyclopentyl(thiophen-2-yl)methyl]thiophene-2-carboxamide
CID 39032304
N-[cyclopentyl(thiophen-2-yl)methyl]-3-(2-hydroxyphenyl)propanamide
CID 47031446
N-[cyclopentyl(thiophen-2-yl)methyl]-2-methoxypropanamide
CID 47307968
N-[cyclopentyl(thiophen-2-yl)methyl]-3-phenoxypropanamide
CID 47031450
2-[[cyclopentyl(thiophen-2-yl)methyl]amino]-N-(2-methylpropyl)acetamide
CID 115900267
tert-butyl N-[1-[[cyclopentyl(thiophen-2-yl)methyl]amino]propan-2-yl]carbamate
CID 107247756

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide (CID 78987130) is 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide is CC(C)(C)NCC(=O)NC(c1cccs1)C1CCCC1.
What is the InChIKey of 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide?
The InChIKey is GDMKGJXSCRSUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2OS/c1-16(2,3)17-11-14(19)18-15(12-7-4-5-8-12)13-9-6-10-20-13/h6,9-10,12,15,17H,4-5,7-8,11H2,1-3H3,(H,18,19).
What are the key properties of 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide?
2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide has a molecular weight of 294.46 g/mol, XLogP of 3.48, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-N-[cyclopentyl(thiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 78987130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).