N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide

C13H23N3O2S — CID 119278298

IUPACN-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(C(=O)C2CSCN2)CC1
InChIInChI=1S/C13H23N3O2S/c1-2-5-14-12(17)10-3-6-16(7-4-10)13(18)11-8-19-9-15-11/h10-11,15H,2-9H2,1H3,(H,14,17)
InChIKeyMBHGODLXGSZDAR-UHFFFAOYSA-N
MW285.41 g/mol
LogP0.41
Rot. Bonds4

About N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide

N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide (PubChem CID 119278298) has the molecular formula C13H23N3O2S and a molecular weight of 285.41 g/mol. Its IUPAC name is N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide
PubChem CID119278298
Molecular FormulaC13H23N3O2S
Molecular Weight285.41 g/mol
Exact Mass285.15
IUPAC NameN-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide
SMILESCCCNC(=O)C1CCN(C(=O)C2CSCN2)CC1
InChIInChI=1S/C13H23N3O2S/c1-2-5-14-12(17)10-3-6-16(7-4-10)13(18)11-8-19-9-15-11/h10-11,15H,2-9H2,1H3,(H,14,17)
InChIKeyMBHGODLXGSZDAR-UHFFFAOYSA-N
XLogP0.41
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-1-(thiomorpholine-3-carbonyl)piperidine-4-carboxamide
CID 82909327
N-(3-hydroxypropyl)-1-(thiomorpholine-3-carbonyl)piperidine-4-carboxamide
CID 82897685
N-butyl-1-[(2S)-pyrrolidine-2-carbonyl]piperidine-4-carboxamide
CID 61163792
1-[4-(1,3-thiazolidine-4-carbonyl)piperazin-1-yl]butan-1-one
CID 110799962
[4-(dimethylamino)piperidin-1-yl]-(1,3-thiazolidin-4-yl)methanone;dihydrochloride
CID 119958530
(4-aminopiperidin-1-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
CID 131101939
N-propyl-1-(2-thiomorpholin-3-ylacetyl)piperidine-4-carboxamide;hydrochloride
CID 119936002
(4-methoxypiperidin-1-yl)-[(4S)-1,3-thiazolidin-4-yl]methanone;hydrochloride
CID 119275333
[3-(diethylamino)pyrrolidin-1-yl]-(1,3-thiazolidin-4-yl)methanone
CID 63166761
1-[4-(1,3-thiazolidine-4-carbonyl)-1,4-diazepan-1-yl]propan-1-one
CID 54916318
N-[2-(diethylamino)ethyl]-1,3-thiazolidine-4-carboxamide
CID 24692990
N-(2-bromoethyl)-1,3-thiazolidine-4-carboxamide
CID 154729350

Frequently Asked Questions

What is the IUPAC name of N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide (CID 119278298) is N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide is CCCNC(=O)C1CCN(C(=O)C2CSCN2)CC1.
What is the InChIKey of N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide?
The InChIKey is MBHGODLXGSZDAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2S/c1-2-5-14-12(17)10-3-6-16(7-4-10)13(18)11-8-19-9-15-11/h10-11,15H,2-9H2,1H3,(H,14,17).
What are the key properties of N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide?
N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide has a molecular weight of 285.41 g/mol, XLogP of 0.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-1-(1,3-thiazolidine-4-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 119278298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).