5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide

C15H20N4O2 — CID 109279520

IUPAC5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(NCc2ccco2)cn1
InChIInChI=1S/C15H20N4O2/c1-11(2)5-6-16-15(20)13-9-19-14(10-17-13)18-8-12-4-3-7-21-12/h3-4,7,9-11H,5-6,8H2,1-2H3,(H,16,20)(H,18,19)
InChIKeyUZIFQTAVOZQWRR-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.46
Rot. Bonds7

About 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide

5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide (PubChem CID 109279520) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide
PubChem CID109279520
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(NCc2ccco2)cn1
InChIInChI=1S/C15H20N4O2/c1-11(2)5-6-16-15(20)13-9-19-14(10-17-13)18-8-12-4-3-7-21-12/h3-4,7,9-11H,5-6,8H2,1-2H3,(H,16,20)(H,18,19)
InChIKeyUZIFQTAVOZQWRR-UHFFFAOYSA-N
XLogP2.46
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-tert-butyl-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109279517
5-(furan-2-ylmethylamino)-N-[2-(4-methoxyphenyl)ethyl]pyrazine-2-carboxamide
CID 109279490
N-[(4-chlorophenyl)methyl]-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109279476
N-[(4-fluorophenyl)methyl]-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109279474
N-cyclopentyl-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109273898
N-[2-(3-chlorophenyl)ethyl]-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109279527
N-[2-(cyclohexen-1-yl)ethyl]-5-(furan-2-ylmethylamino)pyrazine-2-carboxamide
CID 109275380
5-(furan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109279576
5-(furan-2-ylmethylamino)-N-(2,4,6-trimethylphenyl)pyrazine-2-carboxamide
CID 109279550
N-(furan-2-ylmethyl)-2-(3-methylbutylamino)pyrimidine-4-carboxamide
CID 109303470
5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 109279581
5-(4-tert-butylanilino)-N-(furan-2-ylmethyl)pyrazine-2-carboxamide
CID 109279384

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide (CID 109279520) is 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide is CC(C)CCNC(=O)c1cnc(NCc2ccco2)cn1.
What is the InChIKey of 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide?
The InChIKey is UZIFQTAVOZQWRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-11(2)5-6-16-15(20)13-9-19-14(10-17-13)18-8-12-4-3-7-21-12/h3-4,7,9-11H,5-6,8H2,1-2H3,(H,16,20)(H,18,19).
What are the key properties of 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide?
5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.46, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylamino)-N-(3-methylbutyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109279520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).