2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide

C15H26N4OS — CID 56792319

IUPAC2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCCN(CC)CC(=O)NCCc1csc(N2CCCC2)n1
InChIInChI=1S/C15H26N4OS/c1-3-18(4-2)11-14(20)16-8-7-13-12-21-15(17-13)19-9-5-6-10-19/h12H,3-11H2,1-2H3,(H,16,20)
InChIKeyDOESMRWFUCMBFZ-UHFFFAOYSA-N
MW310.47 g/mol
LogP1.74
Rot. Bonds8

About 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide

2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide (PubChem CID 56792319) has the molecular formula C15H26N4OS and a molecular weight of 310.47 g/mol. Its IUPAC name is 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide
PubChem CID56792319
Molecular FormulaC15H26N4OS
Molecular Weight310.47 g/mol
Exact Mass310.18
IUPAC Name2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide
SMILESCCN(CC)CC(=O)NCCc1csc(N2CCCC2)n1
InChIInChI=1S/C15H26N4OS/c1-3-18(4-2)11-14(20)16-8-7-13-12-21-15(17-13)19-9-5-6-10-19/h12H,3-11H2,1-2H3,(H,16,20)
InChIKeyDOESMRWFUCMBFZ-UHFFFAOYSA-N
XLogP1.74
TPSA48.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Hydantoin, 1-(4-ethyl-2-thiazolyl)-
CID 3060453
Hydantoin, 1-(4-(isobutyl)-2-thiazolyl)-
CID 3060454
1-[2-[3-Methyl-4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]acetyl]imidazolidin-2-one
CID 53612097
tert-butyl N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]carbamate
CID 53624906
2-[3-Methyl-4-(4-methyl-1,3-thiazol-2-yl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone
CID 56781020
2-(2-methyl-1,3-thiazol-4-yl)-N-{[2-(1-pyrrolidinyl)-1,3-thiazol-4-yl]methyl}acetamide
CID 70733192
N-(4-(2-(methylamino)-2-oxoethyl)thiazol-2-yl)-5-oxo-1,4-thiazepane-3-carboxamide
CID 71798091
N-(4-methyl-1,3-thiazol-2-yl)-2-[2-(4-methyl-1,3-thiazol-2-yl)butan-2-ylamino]acetamide
CID 71868859
1-Cyclopentyl-1-cyclopropyl-3-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]urea
CID 71925243
3-propan-2-yloxy-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]propanamide
CID 71930766
1-Ethyl-3-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]urea
CID 71994522
2-tert-butylsulfanyl-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide
CID 72010286

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The IUPAC name of 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide (CID 56792319) is 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide.
What is the SMILES notation for 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The canonical SMILES for 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide is CCN(CC)CC(=O)NCCc1csc(N2CCCC2)n1.
What is the InChIKey of 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide?
The InChIKey is DOESMRWFUCMBFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4OS/c1-3-18(4-2)11-14(20)16-8-7-13-12-21-15(17-13)19-9-5-6-10-19/h12H,3-11H2,1-2H3,(H,16,20).
What are the key properties of 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide?
2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide has a molecular weight of 310.47 g/mol, XLogP of 1.74, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[2-(2-pyrrolidin-1-yl-1,3-thiazol-4-yl)ethyl]acetamide is sourced from PubChem (CID 56792319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).