N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide

C13H22N2OS — CID 43750667

IUPACN,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide
SMILESCNC(=O)C(CC(C)C)NC(C)c1cccs1
InChIInChI=1S/C13H22N2OS/c1-9(2)8-11(13(16)14-4)15-10(3)12-6-5-7-17-12/h5-7,9-11,15H,8H2,1-4H3,(H,14,16)
InChIKeyHKLQBZBVRQFHMH-UHFFFAOYSA-N
MW254.40 g/mol
LogP2.56
Rot. Bonds6

About N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide

N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide (PubChem CID 43750667) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide.

Molecular Properties

Compound NameN,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide
PubChem CID43750667
Molecular FormulaC13H22N2OS
Molecular Weight254.40 g/mol
Exact Mass254.15
IUPAC NameN,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide
SMILESCNC(=O)C(CC(C)C)NC(C)c1cccs1
InChIInChI=1S/C13H22N2OS/c1-9(2)8-11(13(16)14-4)15-10(3)12-6-5-7-17-12/h5-7,9-11,15H,8H2,1-4H3,(H,14,16)
InChIKeyHKLQBZBVRQFHMH-UHFFFAOYSA-N
XLogP2.56
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-[[(1S)-1-thiophen-2-ylethyl]amino]propanamide
CID 81408171
2,6-dimethyl-N-(1-thiophen-2-ylethyl)heptan-4-amine
CID 43104723
2-[1-(5-bromofuran-2-yl)ethylamino]-N,4-dimethylpentanamide
CID 104652711
N-(3-methylbutyl)-2-[[(1S)-1-thiophen-2-ylethyl]amino]propanamide
CID 81409142
N-methyl-2-[(3-methyl-1-thiophen-2-ylbutyl)amino]acetamide
CID 115706824
N-propan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
CID 43398665
2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoic acid
CID 113279146
methyl 2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoate
CID 115286243
methyl (2S)-2-[(2-amino-2-thiophen-2-ylacetyl)amino]-4-methylpentanoate
CID 103954898
2-chloro-N-methyl-2-thiophen-2-ylacetamide
CID 10103980
2-[1-(4-fluoro-2-hydroxyphenyl)ethylamino]-N,4-dimethylpentanamide
CID 63067468
N-pentan-2-yl-2-(1-thiophen-2-ylethylamino)propanamide
CID 43420221

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide?
The IUPAC name of N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide (CID 43750667) is N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide.
What is the SMILES notation for N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide?
The canonical SMILES for N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide is CNC(=O)C(CC(C)C)NC(C)c1cccs1.
What is the InChIKey of N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide?
The InChIKey is HKLQBZBVRQFHMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2OS/c1-9(2)8-11(13(16)14-4)15-10(3)12-6-5-7-17-12/h5-7,9-11,15H,8H2,1-4H3,(H,14,16).
What are the key properties of N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide?
N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide has a molecular weight of 254.40 g/mol, XLogP of 2.56, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-(1-thiophen-2-ylethylamino)pentanamide is sourced from PubChem (CID 43750667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).