N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide

C14H22N4O2 — CID 109276630

IUPACN-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(N2CCOCC2)cn1
InChIInChI=1S/C14H22N4O2/c1-11(2)3-4-15-14(19)12-9-17-13(10-16-12)18-5-7-20-8-6-18/h9-11H,3-8H2,1-2H3,(H,15,19)
InChIKeyCZHZHKGXJQONAT-UHFFFAOYSA-N
MW278.36 g/mol
LogP1.09
Rot. Bonds5

About N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide

N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide (PubChem CID 109276630) has the molecular formula C14H22N4O2 and a molecular weight of 278.36 g/mol. Its IUPAC name is N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide
PubChem CID109276630
Molecular FormulaC14H22N4O2
Molecular Weight278.36 g/mol
Exact Mass278.17
IUPAC NameN-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(N2CCOCC2)cn1
InChIInChI=1S/C14H22N4O2/c1-11(2)3-4-15-14(19)12-9-17-13(10-16-12)18-5-7-20-8-6-18/h9-11H,3-8H2,1-2H3,(H,15,19)
InChIKeyCZHZHKGXJQONAT-UHFFFAOYSA-N
XLogP1.09
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274517
N-(2-morpholin-4-ylethyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273701
5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
CID 109275191
N-[2-(2-methoxyphenyl)ethyl]-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109276596
N-cyclopentyl-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109273889
N-[2-(3-methoxyphenyl)ethyl]-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109276597
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 109287769
N-(3-methylbutyl)-5-morpholin-4-ylpyridine-3-carboxamide
CID 109228614
N-pentyl-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274518
N-butyl-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109272354
5-(azepan-1-yl)-N-(3-methoxypropyl)pyrazine-2-carboxamide
CID 109276095
5-(azepan-1-yl)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109195506

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide?
The IUPAC name of N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide (CID 109276630) is N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide is CC(C)CCNC(=O)c1cnc(N2CCOCC2)cn1.
What is the InChIKey of N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide?
The InChIKey is CZHZHKGXJQONAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O2/c1-11(2)3-4-15-14(19)12-9-17-13(10-16-12)18-5-7-20-8-6-18/h9-11H,3-8H2,1-2H3,(H,15,19).
What are the key properties of N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide?
N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide has a molecular weight of 278.36 g/mol, XLogP of 1.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109276630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).