N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide

C11H17NOS — CID 39966816

IUPACN,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide
SMILESCN(Cc1ccsc1)C(=O)C(C)(C)C
InChIInChI=1S/C11H17NOS/c1-11(2,3)10(13)12(4)7-9-5-6-14-8-9/h5-6,8H,7H2,1-4H3
InChIKeyREANVCIGXVRYQB-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.75
Rot. Bonds2

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

N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide (PubChem CID 39966816) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide.

Molecular Properties

Compound NameN,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide
PubChem CID39966816
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC NameN,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide
SMILESCN(Cc1ccsc1)C(=O)C(C)(C)C
InChIInChI=1S/C11H17NOS/c1-11(2,3)10(13)12(4)7-9-5-6-14-8-9/h5-6,8H,7H2,1-4H3
InChIKeyREANVCIGXVRYQB-UHFFFAOYSA-N
XLogP2.75
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2,2-trifluoro-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 62733557
2-amino-N,2-dimethyl-N-(thiophen-3-ylmethyl)butanamide
CID 79797348
2-(ethylamino)-N,2-dimethyl-N-(thiophen-3-ylmethyl)propanamide
CID 62831220
N,2-dimethyl-2-piperazin-1-yl-N-(thiophen-3-ylmethyl)propanamide
CID 80548409
2-(tert-butylamino)-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 112723558
2-[methyl-[methyl(thiophen-3-ylmethyl)carbamoyl]amino]acetic acid
CID 43528522
(E)-N,2-dimethyl-N-(thiophen-3-ylmethyl)pent-2-enamide
CID 94082032
1-methyl-3-propan-2-yl-1-(thiophen-3-ylmethyl)urea
CID 53016506
N-tert-butyl-N-(thiophen-3-ylmethyl)carbamoyl chloride
CID 165496181
2,2-diethyl-4-[methyl(thiophen-3-ylmethyl)amino]-4-oxobutanoic acid
CID 43527995
2-(ethylamino)-N-methyl-N-(thiophen-3-ylmethyl)acetamide
CID 60685569
2-ethyl-2-[[methyl(thiophen-3-ylmethyl)carbamoyl]amino]butanoic acid
CID 79804142

Frequently Asked Questions

What is the IUPAC name of N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide?
The IUPAC name of N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide (CID 39966816) is N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide.
What is the SMILES notation for N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide?
The canonical SMILES for N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide is CN(Cc1ccsc1)C(=O)C(C)(C)C.
What is the InChIKey of N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide?
The InChIKey is REANVCIGXVRYQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-11(2,3)10(13)12(4)7-9-5-6-14-8-9/h5-6,8H,7H2,1-4H3.
What are the key properties of N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide?
N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide has a molecular weight of 211.33 g/mol, XLogP of 2.75, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,2-trimethyl-N-(thiophen-3-ylmethyl)propanamide is sourced from PubChem (CID 39966816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).