(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide

C16H19N3OS — CID 94014669

IUPAC(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
SMILESNC(=O)[C@H]1CCCCN1Cc1csc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3OS/c17-15(20)14-8-4-5-9-19(14)10-13-11-21-16(18-13)12-6-2-1-3-7-12/h1-3,6-7,11,14H,4-5,8-10H2,(H2,17,20)/t14-/m1/s1
InChIKeyYZILFNXZYAZQRX-CQSZACIVSA-N
MW301.41 g/mol
LogP2.65
Rot. Bonds4

About (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide

(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide (PubChem CID 94014669) has the molecular formula C16H19N3OS and a molecular weight of 301.41 g/mol. Its IUPAC name is (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
PubChem CID94014669
Molecular FormulaC16H19N3OS
Molecular Weight301.41 g/mol
Exact Mass301.12
IUPAC Name(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
SMILESNC(=O)[C@H]1CCCCN1Cc1csc(-c2ccccc2)n1
InChIInChI=1S/C16H19N3OS/c17-15(20)14-8-4-5-9-19(14)10-13-11-21-16(18-13)12-6-2-1-3-7-12/h1-3,6-7,11,14H,4-5,8-10H2,(H2,17,20)/t14-/m1/s1
InChIKeyYZILFNXZYAZQRX-CQSZACIVSA-N
XLogP2.65
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrrolidine-2-carboxamide
CID 154828970
1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide
CID 53498925
(2S)-1-[[2-(1,3-benzodioxol-5-yl)-1,3-thiazol-4-yl]methyl]piperidine-2-carboxamide
CID 95161172
2-[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]pyrrolidin-2-yl]acetic acid
CID 61370722
3-amino-N-[[1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidin-2-yl]methyl]propanamide;hydrochloride
CID 120911461
1-[2-(2-phenyl-1,3-thiazol-4-yl)acetyl]piperidine-2-carboxylic acid
CID 119175967
(2R)-1-[(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl]pyrrolidine-2-carboxylic acid;hydrochloride
CID 119913874
(2R)-1-benzylpyrrolidine-2-carboxamide;hydrochloride
CID 141477985
(2R)-1-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methyl]pyrrolidine-2-carboxylic acid
CID 119914241
(2S)-1-(imidazo[1,2-a]pyridin-2-ylmethyl)piperidine-2-carboxamide
CID 95173777
1-methyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]azepane-2-carboxamide
CID 72916172
(2R)-1-methyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]azepane-2-carboxamide
CID 97145298

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide?
The IUPAC name of (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide (CID 94014669) is (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide.
What is the SMILES notation for (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide?
The canonical SMILES for (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide is NC(=O)[C@H]1CCCCN1Cc1csc(-c2ccccc2)n1.
What is the InChIKey of (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide?
The InChIKey is YZILFNXZYAZQRX-CQSZACIVSA-N. The full InChI is InChI=1S/C16H19N3OS/c17-15(20)14-8-4-5-9-19(14)10-13-11-21-16(18-13)12-6-2-1-3-7-12/h1-3,6-7,11,14H,4-5,8-10H2,(H2,17,20)/t14-/m1/s1.
What are the key properties of (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide?
(2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide has a molecular weight of 301.41 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(2-phenyl-1,3-thiazol-4-yl)methyl]piperidine-2-carboxamide is sourced from PubChem (CID 94014669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).