N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide

C13H20N2OS — CID 119573701

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide
SMILESCC(CN)(NC(=O)CCc1cccs1)C1CC1
InChIInChI=1S/C13H20N2OS/c1-13(9-14,10-4-5-10)15-12(16)7-6-11-3-2-8-17-11/h2-3,8,10H,4-7,9,14H2,1H3,(H,15,16)
InChIKeyDQVZIKIFTZQPIS-UHFFFAOYSA-N
MW252.38 g/mol
LogP1.92
Rot. Bonds6

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide

N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide (PubChem CID 119573701) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide
PubChem CID119573701
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide
SMILESCC(CN)(NC(=O)CCc1cccs1)C1CC1
InChIInChI=1S/C13H20N2OS/c1-13(9-14,10-4-5-10)15-12(16)7-6-11-3-2-8-17-11/h2-3,8,10H,4-7,9,14H2,1H3,(H,15,16)
InChIKeyDQVZIKIFTZQPIS-UHFFFAOYSA-N
XLogP1.92
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 51.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-amino-2-cyclopropylpropan-2-yl)-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

Cis-(S)-2-amino-N-((1R,2R)-1-cyano-2-phenylcyclopropyl)-3-(thiophen-2-yl)propanamide
CID 24822701
(S)-2-amino-N-((S)-1-cyano-2-methylpropyl)-3-(thiophen-2-yl)propanamide
CID 46883396
(S)-2-amino-N-(1-cyanocyclopropyl)-3-(thiophen-2-yl)propanamide
CID 46883466
(2S)-2-amino-N-(1-cyano-2,2-dimethylcyclopropyl)-3-(thiophen-2-yl)propanamide
CID 46883469
cis-(S)-2-amino-N-((1S,2S)-1-cyano-2-phenylcyclopropyl)-3-(thiophen-2-yl)propanamide
CID 46883470
(2S)-2-amino-N-(1-cyano-2-phenylcyclopropyl)-3-thiophen-2-ylpropanamide
CID 46883366
(S)-2-amino-N-(2-cyanopropan-2-yl)-3-(thiophen-2-yl)propanamide
CID 46883467
(S)-2-amino-N-(1-cyanocyclobutyl)-3-(thiophen-2-yl)propanamide
CID 46883468
N-(3-methylbutyl)-2-thiophen-2-ylacetamide
CID 670146
N-[2-(thiophen-2-yl)ethyl]cyclohexanecarboxamide
CID 1508406
N-[2-(dimethylamino)ethyl]-2-(thiophen-2-yl)acetamide
CID 803009
N-(1,1-dimethylpropyl)-2-(2-thienyl)acetamide
CID 977581

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide (CID 119573701) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide is CC(CN)(NC(=O)CCc1cccs1)C1CC1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide?
The InChIKey is DQVZIKIFTZQPIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-13(9-14,10-4-5-10)15-12(16)7-6-11-3-2-8-17-11/h2-3,8,10H,4-7,9,14H2,1H3,(H,15,16).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide has a molecular weight of 252.38 g/mol, XLogP of 1.92, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-thiophen-2-ylpropanamide is sourced from PubChem (CID 119573701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).