N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride

C14H18Cl2N4OS — CID 119424673

IUPACN-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NC1CCCNC1)c1cnc(-c2ccncc2)s1
InChIInChI=1S/C14H16N4OS.2ClH/c19-13(18-11-2-1-5-16-8-11)12-9-17-14(20-12)10-3-6-15-7-4-10;;/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,19);2*1H
InChIKeyUHDVQUHARCKWKU-UHFFFAOYSA-N
MW361.30 g/mol
LogP2.53
Rot. Bonds3

About N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride

N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride (PubChem CID 119424673) has the molecular formula C14H18Cl2N4OS and a molecular weight of 361.30 g/mol. Its IUPAC name is N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
PubChem CID119424673
Molecular FormulaC14H18Cl2N4OS
Molecular Weight361.30 g/mol
Exact Mass360.06
IUPAC NameN-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
SMILESCl.Cl.O=C(NC1CCCNC1)c1cnc(-c2ccncc2)s1
InChIInChI=1S/C14H16N4OS.2ClH/c19-13(18-11-2-1-5-16-8-11)12-9-17-14(20-12)10-3-6-15-7-4-10;;/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,19);2*1H
InChIKeyUHDVQUHARCKWKU-UHFFFAOYSA-N
XLogP2.53
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.30
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-piperidin-3-yl-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119427844
N-(piperidin-3-ylmethyl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119460276
2-pyrimidin-2-yl-N-pyrrolidin-3-yl-1,3-thiazole-5-carboxamide
CID 119449848
N-piperidin-3-yl-2-propyl-1,3-thiazole-5-carboxamide
CID 119429304
3-chloro-N-piperidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119426879
N-(2-oxo-1-propan-2-ylpyrrolidin-3-yl)-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 126776676
5-(4-chlorophenyl)-N-piperidin-3-ylthiophene-2-carboxamide
CID 119426767
4,5-dibromo-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide
CID 103866520
4,5-dibromo-N-piperidin-3-ylthiophene-2-carboxamide
CID 80537940
N-[(3S)-2-oxo-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-pyridin-4-yl-1,3-thiazole-5-carboxamide
CID 99819242
N-(2-piperidin-3-ylethyl)-2-pyridin-2-yl-1,3-thiazole-5-carboxamide;dihydrochloride
CID 119558250
N-(azepan-3-yl)-3-chloropyridine-4-carboxamide
CID 66482428

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride?
The IUPAC name of N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride (CID 119424673) is N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride.
What is the SMILES notation for N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride?
The canonical SMILES for N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride is Cl.Cl.O=C(NC1CCCNC1)c1cnc(-c2ccncc2)s1.
What is the InChIKey of N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride?
The InChIKey is UHDVQUHARCKWKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4OS.2ClH/c19-13(18-11-2-1-5-16-8-11)12-9-17-14(20-12)10-3-6-15-7-4-10;;/h3-4,6-7,9,11,16H,1-2,5,8H2,(H,18,19);2*1H.
What are the key properties of N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride?
N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride has a molecular weight of 361.30 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-2-pyridin-4-yl-1,3-thiazole-5-carboxamide;dihydrochloride is sourced from PubChem (CID 119424673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).