N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide

C19H26N4OS — CID 72916413

IUPACN-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide
SMILESCCCc1nc(C(=O)NCC(c2cccnc2)N2CCCCC2)cs1
InChIInChI=1S/C19H26N4OS/c1-2-7-18-22-16(14-25-18)19(24)21-13-17(15-8-6-9-20-12-15)23-10-4-3-5-11-23/h6,8-9,12,14,17H,2-5,7,10-11,13H2,1H3,(H,21,24)
InChIKeyNVXAZPXRAAMBTQ-UHFFFAOYSA-N
MW358.51 g/mol
LogP3.45
Rot. Bonds7

About N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide

N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide (PubChem CID 72916413) has the molecular formula C19H26N4OS and a molecular weight of 358.51 g/mol. Its IUPAC name is N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide
PubChem CID72916413
Molecular FormulaC19H26N4OS
Molecular Weight358.51 g/mol
Exact Mass358.18
IUPAC NameN-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide
SMILESCCCc1nc(C(=O)NCC(c2cccnc2)N2CCCCC2)cs1
InChIInChI=1S/C19H26N4OS/c1-2-7-18-22-16(14-25-18)19(24)21-13-17(15-8-6-9-20-12-15)23-10-4-3-5-11-23/h6,8-9,12,14,17H,2-5,7,10-11,13H2,1H3,(H,21,24)
InChIKeyNVXAZPXRAAMBTQ-UHFFFAOYSA-N
XLogP3.45
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.51
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2R)-2-piperidin-1-yl-2-pyridin-3-ylethyl]-2-propyl-1,3-thiazole-4-carboxamide
CID 97145393
2-ethyl-4-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-1,3-thiazole-5-carboxamide
CID 74246411
1-methyl-N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)pyrrolo[2,3-b]pyridine-6-carboxamide
CID 162626540
N-(2-morpholin-4-yl-2-pyridin-2-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide
CID 72938175
N-[(2R)-2-morpholin-4-yl-2-pyridin-2-ylethyl]-2-propyl-1,3-thiazole-4-carboxamide
CID 97155288
5-[(2-piperidin-1-yl-2-pyridin-3-ylethyl)carbamoyl]thiophene-2-carboxylic acid
CID 74242695
2-(aminomethyl)-N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]-1,3-thiazole-4-carboxamide
CID 119866500
2-(2-ethylsulfanyl-1,3-thiazol-4-yl)-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)acetamide
CID 50967901
2-(2-aminoethyl)-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)-1,3-thiazole-4-carboxamide;dihydrochloride
CID 120639992
1-propyl-N-(2-pyridin-3-yl-2-pyrrolidin-1-ylethyl)pyrazole-4-carboxamide
CID 166207360
N-[(2S)-2-piperidin-1-yl-2-pyridin-3-ylethyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine-2-carboxamide
CID 95714741
N-[(2R)-2-piperidin-1-yl-2-pyridin-3-ylethyl]-2-pyridin-4-ylpyrimidine-5-carboxamide
CID 97187717

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide (CID 72916413) is N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide is CCCc1nc(C(=O)NCC(c2cccnc2)N2CCCCC2)cs1.
What is the InChIKey of N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide?
The InChIKey is NVXAZPXRAAMBTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4OS/c1-2-7-18-22-16(14-25-18)19(24)21-13-17(15-8-6-9-20-12-15)23-10-4-3-5-11-23/h6,8-9,12,14,17H,2-5,7,10-11,13H2,1H3,(H,21,24).
What are the key properties of N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide?
N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide has a molecular weight of 358.51 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-yl-2-pyridin-3-ylethyl)-2-propyl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 72916413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).