N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide

C19H19ClFN5O4 — CID 153448384

IUPACN-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide
SMILESCOc1cc(F)c(-c2nc3cc(Cl)oc3nc2OC)c(NC(=O)N2CCNCC2)c1
InChIInChI=1S/C19H19ClFN5O4/c1-28-10-7-11(21)15(12(8-10)24-19(27)26-5-3-22-4-6-26)16-18(29-2)25-17-13(23-16)9-14(20)30-17/h7-9,22H,3-6H2,1-2H3,(H,24,27)
InChIKeyQPFCEUOGXBTRQG-UHFFFAOYSA-N
MW435.84 g/mol
LogP3.14
Rot. Bonds4

About N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide

N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide (PubChem CID 153448384) has the molecular formula C19H19ClFN5O4 and a molecular weight of 435.84 g/mol. Its IUPAC name is N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide
PubChem CID153448384
Molecular FormulaC19H19ClFN5O4
Molecular Weight435.84 g/mol
Exact Mass435.11
IUPAC NameN-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide
SMILESCOc1cc(F)c(-c2nc3cc(Cl)oc3nc2OC)c(NC(=O)N2CCNCC2)c1
InChIInChI=1S/C19H19ClFN5O4/c1-28-10-7-11(21)15(12(8-10)24-19(27)26-5-3-22-4-6-26)16-18(29-2)25-17-13(23-16)9-14(20)30-17/h7-9,22H,3-6H2,1-2H3,(H,24,27)
InChIKeyQPFCEUOGXBTRQG-UHFFFAOYSA-N
XLogP3.14
TPSA101.75 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.84
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-4-(3-fluoro-5-methoxyphenyl)piperazine-1-carboxamide
CID 138539475
N-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-4-(3,5-dimethylphenyl)piperazine-1-carboxamide
CID 138539557
N-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-4-[3-[2-(dimethylamino)ethoxy]-5-methoxyphenyl]piperazine-1-carboxamide
CID 138539523
N-(4-chloro-2-methylphenyl)piperazine-1-carboxamide
CID 22615613
N-(2-fluoro-5-methoxyphenyl)morpholine-4-carboxamide
CID 115687771
N-(2-chloro-5-methoxyphenyl)morpholine-4-carboxamide
CID 47421313
N-(2,4-difluorophenyl)piperazine-1-carboxamide
CID 43288448
N-(4-bromo-5-chloro-2-methylphenyl)piperazine-1-carboxamide
CID 171916677
N-(2-fluoro-5-methoxyphenyl)azepane-1-carboxamide
CID 115687770
N-(4-methoxyphenyl)-1,4-diazepane-1-carboxamide
CID 16771863
N-(6-chloro-3-ethoxyfuro[2,3-b]pyrazin-2-yl)-4-[3-(trifluoromethoxy)phenyl]piperazine-1-carboxamide
CID 138539510
N-(4-bromo-2-fluorophenyl)piperazine-1-carboxamide
CID 171854873

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide?
The IUPAC name of N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide (CID 153448384) is N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide.
What is the SMILES notation for N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide?
The canonical SMILES for N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide is COc1cc(F)c(-c2nc3cc(Cl)oc3nc2OC)c(NC(=O)N2CCNCC2)c1.
What is the InChIKey of N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide?
The InChIKey is QPFCEUOGXBTRQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19ClFN5O4/c1-28-10-7-11(21)15(12(8-10)24-19(27)26-5-3-22-4-6-26)16-18(29-2)25-17-13(23-16)9-14(20)30-17/h7-9,22H,3-6H2,1-2H3,(H,24,27).
What are the key properties of N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide?
N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide has a molecular weight of 435.84 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-chloro-3-methoxyfuro[2,3-b]pyrazin-2-yl)-3-fluoro-5-methoxyphenyl]piperazine-1-carboxamide is sourced from PubChem (CID 153448384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).