3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

C11H19ClN2OS — CID 119681753

IUPAC3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCN(Cc1cccs1)C(=O)C(C)(C)CN.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-11(2,8-12)10(14)13(3)7-9-5-4-6-15-9;/h4-6H,7-8,12H2,1-3H3;1H
InChIKeyWVQCOZPGJBPGPZ-UHFFFAOYSA-N
MW262.81 g/mol
LogP2.11
Rot. Bonds4

About 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride

3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (PubChem CID 119681753) has the molecular formula C11H19ClN2OS and a molecular weight of 262.81 g/mol. Its IUPAC name is 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.

Molecular Properties

Compound Name3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
PubChem CID119681753
Molecular FormulaC11H19ClN2OS
Molecular Weight262.81 g/mol
Exact Mass262.09
IUPAC Name3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
SMILESCN(Cc1cccs1)C(=O)C(C)(C)CN.Cl
InChIInChI=1S/C11H18N2OS.ClH/c1-11(2,8-12)10(14)13(3)7-9-5-4-6-15-9;/h4-6H,7-8,12H2,1-3H3;1H
InChIKeyWVQCOZPGJBPGPZ-UHFFFAOYSA-N
XLogP2.11
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.81
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-amino-N-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 43527540
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 79652724
N-methyl-3-thiophen-2-yl-N-(thiophen-2-ylmethyl)propanamide
CID 110733634
3-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)propanamide
CID 115139118
3-amino-N-[(5-bromothiophen-2-yl)methyl]-N,2,2-trimethylpropanamide
CID 115154691
4-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)butanamide
CID 79201475
(2R)-2-amino-N,3-dimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 79011600
3-amino-2,2-dimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride
CID 119679292
N-(3-amino-2,2-dimethylpropyl)-N-methyl-4-thiophen-2-ylbutanamide
CID 79652321
N',2,2-trimethyl-N'-(thiophen-2-ylmethyl)butane-1,4-diamine
CID 65247464
N-(3-amino-2,2-dimethylpropyl)-N-methyl-2-thiophen-2-ylacetamide
CID 79653255
2-(2-aminophenyl)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 43527191

Frequently Asked Questions

What is the IUPAC name of 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The IUPAC name of 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride (CID 119681753) is 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride.
What is the SMILES notation for 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The canonical SMILES for 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is CN(Cc1cccs1)C(=O)C(C)(C)CN.Cl.
What is the InChIKey of 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
The InChIKey is WVQCOZPGJBPGPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS.ClH/c1-11(2,8-12)10(14)13(3)7-9-5-4-6-15-9;/h4-6H,7-8,12H2,1-3H3;1H.
What are the key properties of 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride?
3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride has a molecular weight of 262.81 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N,2,2-trimethyl-N-(thiophen-2-ylmethyl)propanamide;hydrochloride is sourced from PubChem (CID 119681753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).