2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide

C14H22N2O2S — CID 107782042

IUPAC2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide
SMILESCCCNC(CSc1ccoc1C)(C(N)=O)C1CC1
InChIInChI=1S/C14H22N2O2S/c1-3-7-16-14(13(15)17,11-4-5-11)9-19-12-6-8-18-10(12)2/h6,8,11,16H,3-5,7,9H2,1-2H3,(H2,15,17)
InChIKeyUXJOJDBSMUNCQR-UHFFFAOYSA-N
MW282.41 g/mol
LogP2.31
Rot. Bonds8

About 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide

2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide (PubChem CID 107782042) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide.

Molecular Properties

Compound Name2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide
PubChem CID107782042
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide
SMILESCCCNC(CSc1ccoc1C)(C(N)=O)C1CC1
InChIInChI=1S/C14H22N2O2S/c1-3-7-16-14(13(15)17,11-4-5-11)9-19-12-6-8-18-10(12)2/h6,8,11,16H,3-5,7,9H2,1-2H3,(H2,15,17)
InChIKeyUXJOJDBSMUNCQR-UHFFFAOYSA-N
XLogP2.31
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide 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

methyl 2-cyclopropyl-2-(methylamino)-3-(2-methylfuran-3-yl)sulfanylpropanoate
CID 107782150
2-cyclopropyl-3-propan-2-ylsulfanyl-2-(propylamino)propanamide
CID 63921417
2-cyclopropyl-3-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]-2-(propylamino)propanamide
CID 63916084
3-butan-2-ylsulfanyl-2-cyclopropyl-2-(propylamino)propanamide
CID 63916489
2-cyclopropyl-3-(2,5-dimethylpyrazol-3-yl)sulfanyl-2-(propylamino)propanamide
CID 63921435
2-cyclopropyl-3-[2-(ethylamino)-2-oxoethyl]sulfanyl-2-(propylamino)propanamide
CID 114234379
2-cyclopropyl-2-(methylamino)-3-(2-methylfuran-3-yl)sulfanylpropan-1-ol
CID 107784660
2-cyclopropyl-2-(ethylamino)-3-[(4-methyl-1,3-oxazol-2-yl)sulfanyl]propanamide
CID 106925112
2,2-dimethyl-3-(2-methylfuran-3-yl)sulfanylpropanoic acid
CID 107779028
2-cyclopropyl-3-(2-methylsulfonylethylsulfanyl)-2-(propylamino)propanamide
CID 63920473
2-amino-2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanylpropanenitrile
CID 107781761
3-(4-chlorophenyl)sulfanyl-2-cyclopropyl-2-(ethylamino)propanamide
CID 63916885

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide?
The IUPAC name of 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide (CID 107782042) is 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide.
What is the SMILES notation for 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide?
The canonical SMILES for 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide is CCCNC(CSc1ccoc1C)(C(N)=O)C1CC1.
What is the InChIKey of 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide?
The InChIKey is UXJOJDBSMUNCQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-3-7-16-14(13(15)17,11-4-5-11)9-19-12-6-8-18-10(12)2/h6,8,11,16H,3-5,7,9H2,1-2H3,(H2,15,17).
What are the key properties of 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide?
2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide has a molecular weight of 282.41 g/mol, XLogP of 2.31, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-3-(2-methylfuran-3-yl)sulfanyl-2-(propylamino)propanamide is sourced from PubChem (CID 107782042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).