4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide

C14H25N3OS — CID 66432298

IUPAC4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)Cc1cccs1
InChIInChI=1S/C14H25N3OS/c1-4-17(5-2)14(18)9-12(10-15)16(3)11-13-7-6-8-19-13/h6-8,12H,4-5,9-11,15H2,1-3H3
InChIKeyPRAMCONATIBDBL-UHFFFAOYSA-N
MW283.44 g/mol
LogP1.77
Rot. Bonds8

About 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide

4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide (PubChem CID 66432298) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide.

Molecular Properties

Compound Name4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide
PubChem CID66432298
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC Name4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide
SMILESCCN(CC)C(=O)CC(CN)N(C)Cc1cccs1
InChIInChI=1S/C14H25N3OS/c1-4-17(5-2)14(18)9-12(10-15)16(3)11-13-7-6-8-19-13/h6-8,12H,4-5,9-11,15H2,1-3H3
InChIKeyPRAMCONATIBDBL-UHFFFAOYSA-N
XLogP1.77
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-ethyl-3-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 81087639
2-(aminomethyl)-N-ethyl-3-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 65230128
4-amino-N,N-diethyl-3-[methyl(2-phenylethyl)amino]butanamide
CID 66432918
3-(4-aminophenyl)-N-ethyl-N-(thiophen-2-ylmethyl)butanamide
CID 104502284
ethyl 2-[bis(thiophen-2-ylmethyl)amino]-2-oxoacetate
CID 166273196
N-ethyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 78801832
1,3-diethyl-1-methyl-3-(thiophen-2-ylmethyl)urea
CID 116654591
3-methyl-2-[methyl(thiophen-2-ylmethyl)amino]butanoic acid
CID 43527695
3-amino-N-ethyl-N-(2-thiophen-2-ylethyl)propanamide;hydrochloride
CID 119292705
(2S)-2-amino-N,N-bis(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119271767
2-amino-N-ethyl-3-methyl-N-(thiophen-2-ylmethyl)butanamide;hydrochloride
CID 119271522
4-amino-N,N-diethyl-3-[methyl(2-pyridin-2-ylethyl)amino]butanamide
CID 66430451

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide?
The IUPAC name of 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide (CID 66432298) is 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide.
What is the SMILES notation for 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide?
The canonical SMILES for 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide is CCN(CC)C(=O)CC(CN)N(C)Cc1cccs1.
What is the InChIKey of 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide?
The InChIKey is PRAMCONATIBDBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-4-17(5-2)14(18)9-12(10-15)16(3)11-13-7-6-8-19-13/h6-8,12H,4-5,9-11,15H2,1-3H3.
What are the key properties of 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide?
4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide has a molecular weight of 283.44 g/mol, XLogP of 1.77, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N-diethyl-3-[methyl(thiophen-2-ylmethyl)amino]butanamide is sourced from PubChem (CID 66432298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).