5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide

C14H24N2OS — CID 104684884

IUPAC5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide
SMILESCCCC(NC(=O)C(C)CCCN)c1cccs1
InChIInChI=1S/C14H24N2OS/c1-3-6-12(13-8-5-10-18-13)16-14(17)11(2)7-4-9-15/h5,8,10-12H,3-4,6-7,9,15H2,1-2H3,(H,16,17)
InChIKeyNURCZSDAUAOSPE-UHFFFAOYSA-N
MW268.43 g/mol
LogP3.08
Rot. Bonds8

About 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide

5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide (PubChem CID 104684884) has the molecular formula C14H24N2OS and a molecular weight of 268.43 g/mol. Its IUPAC name is 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide.

Molecular Properties

Compound Name5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide
PubChem CID104684884
Molecular FormulaC14H24N2OS
Molecular Weight268.43 g/mol
Exact Mass268.16
IUPAC Name5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide
SMILESCCCC(NC(=O)C(C)CCCN)c1cccs1
InChIInChI=1S/C14H24N2OS/c1-3-6-12(13-8-5-10-18-13)16-14(17)11(2)7-4-9-15/h5,8,10-12H,3-4,6-7,9,15H2,1-2H3,(H,16,17)
InChIKeyNURCZSDAUAOSPE-UHFFFAOYSA-N
XLogP3.08
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.43
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(5-amino-2-methylpentanoyl)amino]-3-thiophen-2-ylpropanoic acid
CID 104684115
5-amino-2-methyl-N-[(1R)-1-thiophen-2-ylethyl]pentanamide
CID 104685412
2-methyl-3-(methylamino)-N-(1-thiophen-2-ylbutyl)propanamide
CID 79203080
2-(aminomethyl)-N-(1-thiophen-2-ylbutyl)butanamide
CID 65229248
2-bromo-N-(1-thiophen-2-ylbutyl)propanamide
CID 107904985
2,2-difluoro-N-(1-thiophen-2-ylbutyl)acetamide
CID 103515707
2-amino-5-methoxy-N-(1-thiophen-2-ylbutyl)pentanamide
CID 81087987
(2R)-2-amino-3-phenyl-N-(1-thiophen-2-ylbutyl)propanamide
CID 78984626
3-amino-3-sulfanylidene-N-(1-thiophen-2-ylbutyl)propanamide
CID 55134581
3-oxo-3-(1-thiophen-2-ylbutylamino)propanoic acid
CID 62231148
1-(aminomethyl)-N-(1-thiophen-2-ylbutyl)cyclopentane-1-carboxamide
CID 115435212
6-amino-2-methyl-N-(2-methyl-1-thiophen-2-ylpropyl)heptanamide
CID 65290946

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide?
The IUPAC name of 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide (CID 104684884) is 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide.
What is the SMILES notation for 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide?
The canonical SMILES for 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide is CCCC(NC(=O)C(C)CCCN)c1cccs1.
What is the InChIKey of 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide?
The InChIKey is NURCZSDAUAOSPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OS/c1-3-6-12(13-8-5-10-18-13)16-14(17)11(2)7-4-9-15/h5,8,10-12H,3-4,6-7,9,15H2,1-2H3,(H,16,17).
What are the key properties of 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide?
5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide has a molecular weight of 268.43 g/mol, XLogP of 3.08, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-N-(1-thiophen-2-ylbutyl)pentanamide is sourced from PubChem (CID 104684884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).