(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide

C15H15F2N3O3S — CID 26027113

IUPAC(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide
SMILESNC(=O)N[C@H](CC(=O)Nc1ccc(OC(F)F)cc1)c1cccs1
InChIInChI=1S/C15H15F2N3O3S/c16-14(17)23-10-5-3-9(4-6-10)19-13(21)8-11(20-15(18)22)12-2-1-7-24-12/h1-7,11,14H,8H2,(H,19,21)(H3,18,20,22)/t11-/m1/s1
InChIKeyVOLSBGQFFOJVEN-LLVKDONJSA-N
MW355.37 g/mol
LogP3.09
Rot. Bonds7

About (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide

(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide (PubChem CID 26027113) has the molecular formula C15H15F2N3O3S and a molecular weight of 355.37 g/mol. Its IUPAC name is (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound Name(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide
PubChem CID26027113
Molecular FormulaC15H15F2N3O3S
Molecular Weight355.37 g/mol
Exact Mass355.08
IUPAC Name(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide
SMILESNC(=O)N[C@H](CC(=O)Nc1ccc(OC(F)F)cc1)c1cccs1
InChIInChI=1S/C15H15F2N3O3S/c16-14(17)23-10-5-3-9(4-6-10)19-13(21)8-11(20-15(18)22)12-2-1-7-24-12/h1-7,11,14H,8H2,(H,19,21)(H3,18,20,22)/t11-/m1/s1
InChIKeyVOLSBGQFFOJVEN-LLVKDONJSA-N
XLogP3.09
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.37
LogP ≤ 53.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-anilinophenyl)-3-(carbamoylamino)-3-thiophen-2-ylpropanamide
CID 75866480
3-(carbamoylamino)-N-(4-cyclopentyloxyphenyl)-3-thiophen-2-ylpropanamide
CID 55577985
3-(carbamoylamino)-N-(4-propan-2-ylphenyl)-3-thiophen-2-ylpropanamide
CID 51311861
2-amino-N-[4-(difluoromethoxy)phenyl]-2-thiophen-2-ylacetamide
CID 115286009
N-[4-[(4-benzylpiperazin-1-yl)methyl]phenyl]-3-(carbamoylamino)-3-thiophen-2-ylpropanamide
CID 60511072
N-[3-(4-bromoanilino)-3-oxopropyl]-3-(carbamoylamino)-3-thiophen-2-ylpropanamide
CID 55951845
2-[[amino(thiophen-2-yl)methylidene]amino]oxy-N-[4-(difluoromethoxy)phenyl]acetamide
CID 75621361
3-acetamido-N-[4-[(2-methoxyacetyl)amino]phenyl]-3-thiophen-2-ylpropanamide
CID 55573033
N-(2-acetamido-4,5-difluorophenyl)-3-(carbamoylamino)-3-thiophen-2-ylpropanamide
CID 60618030
(3S)-3-acetamido-N-[4-(difluoromethoxy)phenyl]-3-phenylpropanamide
CID 8502651
3-(carbamoylamino)-N-(3-methylbutan-2-yl)-3-thiophen-2-ylpropanamide
CID 47137941
(3S)-3-(carbamoylamino)-N-[(2S)-3-methylbutan-2-yl]-3-thiophen-2-ylpropanamide
CID 94193166

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide?
The IUPAC name of (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide (CID 26027113) is (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide.
What is the SMILES notation for (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide?
The canonical SMILES for (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide is NC(=O)N[C@H](CC(=O)Nc1ccc(OC(F)F)cc1)c1cccs1.
What is the InChIKey of (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide?
The InChIKey is VOLSBGQFFOJVEN-LLVKDONJSA-N. The full InChI is InChI=1S/C15H15F2N3O3S/c16-14(17)23-10-5-3-9(4-6-10)19-13(21)8-11(20-15(18)22)12-2-1-7-24-12/h1-7,11,14H,8H2,(H,19,21)(H3,18,20,22)/t11-/m1/s1.
What are the key properties of (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide?
(3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide has a molecular weight of 355.37 g/mol, XLogP of 3.09, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 26027113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).