N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide

C14H21N5O2S — CID 22513592

IUPACN-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide
SMILESCN(CC(=O)NC1CCCC1)c1nnc(N2CCCC2=O)s1
InChIInChI=1S/C14H21N5O2S/c1-18(9-11(20)15-10-5-2-3-6-10)13-16-17-14(22-13)19-8-4-7-12(19)21/h10H,2-9H2,1H3,(H,15,20)
InChIKeyFUXCZTWIPSUTBL-UHFFFAOYSA-N
MW323.42 g/mol
LogP1.16
Rot. Bonds5

About N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide

N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide (PubChem CID 22513592) has the molecular formula C14H21N5O2S and a molecular weight of 323.42 g/mol. Its IUPAC name is N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide
PubChem CID22513592
Molecular FormulaC14H21N5O2S
Molecular Weight323.42 g/mol
Exact Mass323.14
IUPAC NameN-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide
SMILESCN(CC(=O)NC1CCCC1)c1nnc(N2CCCC2=O)s1
InChIInChI=1S/C14H21N5O2S/c1-18(9-11(20)15-10-5-2-3-6-10)13-16-17-14(22-13)19-8-4-7-12(19)21/h10H,2-9H2,1H3,(H,15,20)
InChIKeyFUXCZTWIPSUTBL-UHFFFAOYSA-N
XLogP1.16
TPSA78.43 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide?
The IUPAC name of N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide (CID 22513592) is N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide.
What is the SMILES notation for N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide?
The canonical SMILES for N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide is CN(CC(=O)NC1CCCC1)c1nnc(N2CCCC2=O)s1.
What is the InChIKey of N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide?
The InChIKey is FUXCZTWIPSUTBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O2S/c1-18(9-11(20)15-10-5-2-3-6-10)13-16-17-14(22-13)19-8-4-7-12(19)21/h10H,2-9H2,1H3,(H,15,20).
What are the key properties of N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide?
N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide has a molecular weight of 323.42 g/mol, XLogP of 1.16, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[methyl-[5-(2-oxopyrrolidin-1-yl)-1,3,4-thiadiazol-2-yl]amino]acetamide is sourced from PubChem (CID 22513592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).