N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide

C15H23N3OS — CID 47076990

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1nc(C)c(C(=O)NC2CCN(C3CC3)C2)s1
InChIInChI=1S/C15H23N3OS/c1-3-4-13-16-10(2)14(20-13)15(19)17-11-7-8-18(9-11)12-5-6-12/h11-12H,3-9H2,1-2H3,(H,17,19)
InChIKeyGTKZSFNFYZDPKX-UHFFFAOYSA-N
MW293.44 g/mol
LogP2.37
Rot. Bonds5

About N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide

N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide (PubChem CID 47076990) has the molecular formula C15H23N3OS and a molecular weight of 293.44 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide
PubChem CID47076990
Molecular FormulaC15H23N3OS
Molecular Weight293.44 g/mol
Exact Mass293.16
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide
SMILESCCCc1nc(C)c(C(=O)NC2CCN(C3CC3)C2)s1
InChIInChI=1S/C15H23N3OS/c1-3-4-13-16-10(2)14(20-13)15(19)17-11-7-8-18(9-11)12-5-6-12/h11-12H,3-9H2,1-2H3,(H,17,19)
InChIKeyGTKZSFNFYZDPKX-UHFFFAOYSA-N
XLogP2.37
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide (CID 47076990) is N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide is CCCc1nc(C)c(C(=O)NC2CCN(C3CC3)C2)s1.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide?
The InChIKey is GTKZSFNFYZDPKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3OS/c1-3-4-13-16-10(2)14(20-13)15(19)17-11-7-8-18(9-11)12-5-6-12/h11-12H,3-9H2,1-2H3,(H,17,19).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide?
N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide has a molecular weight of 293.44 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-4-methyl-2-propyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 47076990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).