3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide

C16H27N3O2S — CID 119461517

IUPAC3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NCC1CCCNC1)C1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C16H27N3O2S/c20-15(18-9-12-4-3-7-17-8-12)14-10-22-11-19(14)16(21)13-5-1-2-6-13/h12-14,17H,1-11H2,(H,18,20)
InChIKeyKFRNOCQAPGWQMN-UHFFFAOYSA-N
MW325.48 g/mol
LogP1.19
Rot. Bonds4

About 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide

3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide (PubChem CID 119461517) has the molecular formula C16H27N3O2S and a molecular weight of 325.48 g/mol. Its IUPAC name is 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide.

Molecular Properties

Compound Name3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide
PubChem CID119461517
Molecular FormulaC16H27N3O2S
Molecular Weight325.48 g/mol
Exact Mass325.18
IUPAC Name3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide
SMILESO=C(NCC1CCCNC1)C1CSCN1C(=O)C1CCCC1
InChIInChI=1S/C16H27N3O2S/c20-15(18-9-12-4-3-7-17-8-12)14-10-22-11-19(14)16(21)13-5-1-2-6-13/h12-14,17H,1-11H2,(H,18,20)
InChIKeyKFRNOCQAPGWQMN-UHFFFAOYSA-N
XLogP1.19
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.48
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(cyclopentanecarbonyl)-N-(2-piperidin-3-ylethyl)-1,3-thiazolidine-4-carboxamide;hydrochloride
CID 119556578
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614
N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide;hydrochloride
CID 119260134
N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 43371173
(3S)-N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 81123262
3-(cyclopentanecarbonyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-1,3-thiazolidine-4-carboxamide
CID 120887829
(4R)-N-(3-amino-2,2-dimethyl-3-oxopropyl)-3-(cyclopentanecarbonyl)-1,3-thiazolidine-4-carboxamide
CID 95321789
2,2,3,3-tetramethyl-N-(piperidin-3-ylmethyl)cyclopropane-1-carboxamide
CID 66475790
4-(cyclopentanecarbonylamino)-N-(piperidin-3-ylmethyl)cyclohexane-1-carboxamide;hydrochloride
CID 119463290
(4R)-3-(cyclopentanecarbonyl)-N-[3-(dimethylamino)-2,2-dimethylpropyl]-1,3-thiazolidine-4-carboxamide
CID 95334963
N-(piperidin-3-ylmethyl)azepane-1-carboxamide
CID 79152631

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The IUPAC name of 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide (CID 119461517) is 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide.
What is the SMILES notation for 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The canonical SMILES for 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide is O=C(NCC1CCCNC1)C1CSCN1C(=O)C1CCCC1.
What is the InChIKey of 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide?
The InChIKey is KFRNOCQAPGWQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2S/c20-15(18-9-12-4-3-7-17-8-12)14-10-22-11-19(14)16(21)13-5-1-2-6-13/h12-14,17H,1-11H2,(H,18,20).
What are the key properties of 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide?
3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide has a molecular weight of 325.48 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentanecarbonyl)-N-(piperidin-3-ylmethyl)-1,3-thiazolidine-4-carboxamide is sourced from PubChem (CID 119461517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).