N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide

C16H19N3O3S — CID 119462737

IUPACN-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
SMILESO=C(Nc1sccc1C(=O)NCC1CCCNC1)c1ccco1
InChIInChI=1S/C16H19N3O3S/c20-14(18-10-11-3-1-6-17-9-11)12-5-8-23-16(12)19-15(21)13-4-2-7-22-13/h2,4-5,7-8,11,17H,1,3,6,9-10H2,(H,18,20)(H,19,21)
InChIKeyADFPXRUXUINLPD-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.32
Rot. Bonds5

About N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide

N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide (PubChem CID 119462737) has the molecular formula C16H19N3O3S and a molecular weight of 333.41 g/mol. Its IUPAC name is N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
PubChem CID119462737
Molecular FormulaC16H19N3O3S
Molecular Weight333.41 g/mol
Exact Mass333.11
IUPAC NameN-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
SMILESO=C(Nc1sccc1C(=O)NCC1CCCNC1)c1ccco1
InChIInChI=1S/C16H19N3O3S/c20-14(18-10-11-3-1-6-17-9-11)12-5-8-23-16(12)19-15(21)13-4-2-7-22-13/h2,4-5,7-8,11,17H,1,3,6,9-10H2,(H,18,20)(H,19,21)
InChIKeyADFPXRUXUINLPD-UHFFFAOYSA-N
XLogP2.32
TPSA83.37 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.32
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(4-chloro-2-hydroxybenzoyl)amino]-N-(piperidin-3-ylmethyl)thiophene-3-carboxamide
CID 119462858
2-(2,3-dihydro-1H-indene-5-carbonylamino)-N-(piperidin-3-ylmethyl)thiophene-3-carboxamide
CID 119462719
N-[1-oxo-3-phenyl-1-(piperidin-3-ylmethylamino)propan-2-yl]furan-2-carboxamide;hydrochloride
CID 119462989
N-[3-[(2-amino-2-methylpropyl)carbamoyl]thiophen-2-yl]furan-2-carboxamide;hydrochloride
CID 119628741
2-methyl-N-(piperidin-3-ylmethyl)furan-3-carboxamide
CID 60725298
N-[3-[2-oxo-2-(piperidin-3-ylmethylamino)ethoxy]phenyl]furan-2-carboxamide;hydrochloride
CID 119462625
N-[3-(8-azabicyclo[3.2.1]octan-3-ylcarbamoyl)thiophen-2-yl]furan-2-carboxamide
CID 119457842
N-[3-[4-(ethylaminomethyl)piperidine-1-carbonyl]thiophen-2-yl]furan-2-carboxamide
CID 119646754
N-[3-[(2-amino-1-cyclohexylethyl)carbamoyl]thiophen-2-yl]furan-2-carboxamide;hydrochloride
CID 119590926
2-benzyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462305
2-phenyl-N-[[(3R)-piperidin-3-yl]methyl]acetamide;hydrochloride
CID 166436266
N-[3-[3-(aminomethyl)pyrrolidine-1-carbonyl]thiophen-2-yl]furan-2-carboxamide;hydrochloride
CID 119485706

Frequently Asked Questions

What is the IUPAC name of N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The IUPAC name of N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide (CID 119462737) is N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide is O=C(Nc1sccc1C(=O)NCC1CCCNC1)c1ccco1.
What is the InChIKey of N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
The InChIKey is ADFPXRUXUINLPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O3S/c20-14(18-10-11-3-1-6-17-9-11)12-5-8-23-16(12)19-15(21)13-4-2-7-22-13/h2,4-5,7-8,11,17H,1,3,6,9-10H2,(H,18,20)(H,19,21).
What are the key properties of N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide?
N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide has a molecular weight of 333.41 g/mol, XLogP of 2.32, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(piperidin-3-ylmethylcarbamoyl)thiophen-2-yl]furan-2-carboxamide is sourced from PubChem (CID 119462737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).