N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide

C19H20N4O2S — CID 42857346

IUPACN-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(Cc3ccoc3)CC2)nc1)c1cccs1
InChIInChI=1S/C19H20N4O2S/c24-19(17-2-1-11-26-17)21-16-3-4-18(20-12-16)23-8-6-22(7-9-23)13-15-5-10-25-14-15/h1-5,10-12,14H,6-9,13H2,(H,21,24)
InChIKeyYHAFYZLXSWJJHD-UHFFFAOYSA-N
MW368.46 g/mol
LogP3.31
Rot. Bonds5

About N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide

N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide (PubChem CID 42857346) has the molecular formula C19H20N4O2S and a molecular weight of 368.46 g/mol. Its IUPAC name is N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide
PubChem CID42857346
Molecular FormulaC19H20N4O2S
Molecular Weight368.46 g/mol
Exact Mass368.13
IUPAC NameN-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(N2CCN(Cc3ccoc3)CC2)nc1)c1cccs1
InChIInChI=1S/C19H20N4O2S/c24-19(17-2-1-11-26-17)21-16-3-4-18(20-12-16)23-8-6-22(7-9-23)13-15-5-10-25-14-15/h1-5,10-12,14H,6-9,13H2,(H,21,24)
InChIKeyYHAFYZLXSWJJHD-UHFFFAOYSA-N
XLogP3.31
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[5-(thiophene-2-carbonylamino)pyridin-2-yl]furan-2-carboxamide
CID 647091
N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]-5-methylthiophene-3-carboxamide
CID 118707828
5-(furan-2-yl)-N-methyl-3-(thiophen-2-yl)-3H-pyrido[2,3-e][1,4]diazepin-2-amine
CID 135423770
2-(furan-3-yl)-N-(thiophen-2-ylmethyl)pyrimidin-4-amine
CID 3234864
N-[6-[(5-fluoro-3-pyridinyl)oxy]pyrazin-2-yl]thiophene-3-carboxamide
CID 118707814
3-Fluoro-N-(6-{4-[(furan-3-YL)methyl]piperazin-1-YL}pyridin-3-YL)benzamide
CID 46053706
4-[[4-(furan-3-ylmethyl)-3,5-dihydro-2H-pyrido[2,3-e][1,4]diazepin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 97520922
5-(furan-3-yl)-3-(thiophen-2-ylmethyl)-1H-imidazo[4,5-b]pyrazin-2-one
CID 172433690
3-(furan-3-yl)-N-(thiophen-2-ylmethyl)pyrazin-2-amine
CID 172433869
N-(2-piperazin-1-yl-3-pyridinyl)furan-3-carboxamide
CID 172438066
N-(2-{[(Furan-2-YL)methyl]sulfanyl}ethyl)-1-{[1,3]thiazolo[5,4-B]pyridin-2-YL}piperidine-4-carboxamide
CID 20952101
N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]-3-methylbenzamide
CID 46161195

Frequently Asked Questions

What is the IUPAC name of N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide?
The IUPAC name of N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide (CID 42857346) is N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide?
The canonical SMILES for N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide is O=C(Nc1ccc(N2CCN(Cc3ccoc3)CC2)nc1)c1cccs1.
What is the InChIKey of N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide?
The InChIKey is YHAFYZLXSWJJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2S/c24-19(17-2-1-11-26-17)21-16-3-4-18(20-12-16)23-8-6-22(7-9-23)13-15-5-10-25-14-15/h1-5,10-12,14H,6-9,13H2,(H,21,24).
What are the key properties of N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide?
N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide has a molecular weight of 368.46 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[4-(furan-3-ylmethyl)piperazin-1-yl]-3-pyridinyl]thiophene-2-carboxamide is sourced from PubChem (CID 42857346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).