N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide

C18H20N4OS — CID 166299045

IUPACN-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCN(C(=O)c1csc(C2CCCNC2)n1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C18H20N4OS/c1-22(14-5-4-12-6-8-20-15(12)9-14)18(23)16-11-24-17(21-16)13-3-2-7-19-10-13/h4-6,8-9,11,13,19-20H,2-3,7,10H2,1H3
InChIKeyKLTPKBGPWBVNJA-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.37
Rot. Bonds3

About N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide

N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide (PubChem CID 166299045) has the molecular formula C18H20N4OS and a molecular weight of 340.45 g/mol. Its IUPAC name is N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide
PubChem CID166299045
Molecular FormulaC18H20N4OS
Molecular Weight340.45 g/mol
Exact Mass340.14
IUPAC NameN-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide
SMILESCN(C(=O)c1csc(C2CCCNC2)n1)c1ccc2cc[nH]c2c1
InChIInChI=1S/C18H20N4OS/c1-22(14-5-4-12-6-8-20-15(12)9-14)18(23)16-11-24-17(21-16)13-3-2-7-19-10-13/h4-6,8-9,11,13,19-20H,2-3,7,10H2,1H3
InChIKeyKLTPKBGPWBVNJA-UHFFFAOYSA-N
XLogP3.37
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

azocan-1-yl-(2-piperidin-3-yl-1,3-thiazol-4-yl)methanone
CID 3678062
2-piperidin-3-yl-1,3-thiazol-4-ol
CID 83684160
N-[(2,5-difluorophenyl)methyl]-2-piperidin-3-yl-1,3-thiazole-4-carboxamide
CID 3846497
5-cyclopropyl-N-(1H-indol-5-yl)-N-methyl-1,2-oxazole-3-carboxamide
CID 166285106
4-methyl-2-[(3S)-piperidin-3-yl]-1,3-thiazole
CID 42078596
N-cyclohexyl-N-methyl-2-piperidin-4-yl-1,3-thiazole-4-carboxamide
CID 23765843
N-(2,3-dihydro-1H-inden-1-yl)-2-piperidin-3-yl-1,3-thiazole-4-carboxamide
CID 3715181
N-piperidin-3-yl-N-propyl-1H-indole-6-carboxamide
CID 63748800
4-(3-methylphenyl)-2-piperidin-3-yl-1,3-thiazole
CID 62540732
6-pyrrolidin-3-yl-1H-indole
CID 82602367
4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-piperidin-3-yl-1,3-thiazole
CID 62541597
2-piperidin-3-yl-4-(2,4,5-trimethylphenyl)-1,3-thiazole
CID 62795975

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide (CID 166299045) is N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide is CN(C(=O)c1csc(C2CCCNC2)n1)c1ccc2cc[nH]c2c1.
What is the InChIKey of N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide?
The InChIKey is KLTPKBGPWBVNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4OS/c1-22(14-5-4-12-6-8-20-15(12)9-14)18(23)16-11-24-17(21-16)13-3-2-7-19-10-13/h4-6,8-9,11,13,19-20H,2-3,7,10H2,1H3.
What are the key properties of N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide?
N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 3.37, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-6-yl)-N-methyl-2-piperidin-3-yl-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 166299045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).