N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide

C14H25N3OS — CID 106285571

IUPACN-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
SMILESCCC(CC)C1CN=C(NC(C)C(=O)NC2CC2)S1
InChIInChI=1S/C14H25N3OS/c1-4-10(5-2)12-8-15-14(19-12)16-9(3)13(18)17-11-6-7-11/h9-12H,4-8H2,1-3H3,(H,15,16)(H,17,18)
InChIKeyWCGFXOUONBLKHD-UHFFFAOYSA-N
MW283.44 g/mol
LogP2.15
Rot. Bonds6

About N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide

N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide (PubChem CID 106285571) has the molecular formula C14H25N3OS and a molecular weight of 283.44 g/mol. Its IUPAC name is N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
PubChem CID106285571
Molecular FormulaC14H25N3OS
Molecular Weight283.44 g/mol
Exact Mass283.17
IUPAC NameN-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
SMILESCCC(CC)C1CN=C(NC(C)C(=O)NC2CC2)S1
InChIInChI=1S/C14H25N3OS/c1-4-10(5-2)12-8-15-14(19-12)16-9(3)13(18)17-11-6-7-11/h9-12H,4-8H2,1-3H3,(H,15,16)(H,17,18)
InChIKeyWCGFXOUONBLKHD-UHFFFAOYSA-N
XLogP2.15
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
CID 106285002
N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]acetamide
CID 106284971
N-cyclopropyl-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106284732
N-(4-methylsulfanylbutan-2-yl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 114168388
5-pentan-3-yl-N-(2,2,3-trimethylbutyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 106285842
N-cyclopropyl-3-[(5-propan-2-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide
CID 113492504
N-(1-morpholin-4-ylpropan-2-yl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285037
N-[4-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]phenyl]acetamide
CID 106284715
2-[[5-(2,2-dimethylpropyl)-4,5-dihydro-1,3-thiazol-2-yl]amino]-N-propylpropanamide
CID 107154089
N-(4-methylpiperazin-1-yl)-5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 106285529
3-amino-5-[[1-(cyclopropylamino)-1-oxopropan-2-yl]amino]-1,2-thiazole-4-carboxamide
CID 103383966
2-methyl-N-[4-(2-methylpropanoylamino)cyclohexyl]propanamide
CID 5083762

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide (CID 106285571) is N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide is CCC(CC)C1CN=C(NC(C)C(=O)NC2CC2)S1.
What is the InChIKey of N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
The InChIKey is WCGFXOUONBLKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3OS/c1-4-10(5-2)12-8-15-14(19-12)16-9(3)13(18)17-11-6-7-11/h9-12H,4-8H2,1-3H3,(H,15,16)(H,17,18).
What are the key properties of N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide?
N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide has a molecular weight of 283.44 g/mol, XLogP of 2.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(5-pentan-3-yl-4,5-dihydro-1,3-thiazol-2-yl)amino]propanamide is sourced from PubChem (CID 106285571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).