N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide

C19H20N4O2S — CID 175651033

IUPACN-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc2sc(N3CCC(NC(=O)c4cccnc4)CC3)nc2c1
InChIInChI=1S/C19H20N4O2S/c1-25-15-4-5-17-16(11-15)22-19(26-17)23-9-6-14(7-10-23)21-18(24)13-3-2-8-20-12-13/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H,21,24)
InChIKeyMUGKYXSCMOBSKY-UHFFFAOYSA-N
MW368.46 g/mol
LogP3.10
Rot. Bonds4

About N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide

N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide (PubChem CID 175651033) has the molecular formula C19H20N4O2S and a molecular weight of 368.46 g/mol. Its IUPAC name is N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide
PubChem CID175651033
Molecular FormulaC19H20N4O2S
Molecular Weight368.46 g/mol
Exact Mass368.13
IUPAC NameN-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide
SMILESCOc1ccc2sc(N3CCC(NC(=O)c4cccnc4)CC3)nc2c1
InChIInChI=1S/C19H20N4O2S/c1-25-15-4-5-17-16(11-15)22-19(26-17)23-9-6-14(7-10-23)21-18(24)13-3-2-8-20-12-13/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H,21,24)
InChIKeyMUGKYXSCMOBSKY-UHFFFAOYSA-N
XLogP3.10
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]-1-methylpyrazole-4-carboxamide
CID 171997837
N-[1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidin-4-yl]pyridine-4-carboxamide
CID 172903534
N-[1-(6-ethoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]pyridine-3-carboxamide
CID 175651185
N-[1-[3-(4-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836676
N-[1-(1,3-benzothiazol-2-yl)piperidin-4-yl]-2-methoxypyridine-3-carboxamide
CID 166190921
N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]-N-methylcyclopropanecarboxamide
CID 171328851
N-[1-(5-bromo-4-methoxypyrimidin-2-yl)piperidin-4-yl]pyridine-3-carboxamide
CID 175649555
N-[1-[3-(3-methoxyphenyl)propanoyl]piperidin-4-yl]pyridine-3-carboxamide
CID 47836658
N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-3-yl]cyclopropanecarboxamide
CID 163346079
N-[1-[[1-(4-methoxyphenyl)cyclohexyl]methyl]piperidin-4-yl]pyridine-3-carboxamide
CID 95853242
2,5-dimethyl-N-[1-([1,3]thiazolo[4,5-c]pyridin-2-yl)piperidin-4-yl]pyrazole-3-carboxamide
CID 172902834
N-[1-(3-methoxypyrazin-2-yl)pyrrolidin-3-yl]pyridine-3-carboxamide
CID 53185597

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide?
The IUPAC name of N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide (CID 175651033) is N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide is COc1ccc2sc(N3CCC(NC(=O)c4cccnc4)CC3)nc2c1.
What is the InChIKey of N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide?
The InChIKey is MUGKYXSCMOBSKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2S/c1-25-15-4-5-17-16(11-15)22-19(26-17)23-9-6-14(7-10-23)21-18(24)13-3-2-8-20-12-13/h2-5,8,11-12,14H,6-7,9-10H2,1H3,(H,21,24).
What are the key properties of N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide?
N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide has a molecular weight of 368.46 g/mol, XLogP of 3.10, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methoxy-1,3-benzothiazol-2-yl)piperidin-4-yl]pyridine-3-carboxamide is sourced from PubChem (CID 175651033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).