N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide

C15H24N4O — CID 109274517

IUPACN-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C15H24N4O/c1-12(2)6-7-16-15(20)13-10-18-14(11-17-13)19-8-4-3-5-9-19/h10-12H,3-9H2,1-2H3,(H,16,20)
InChIKeyRIVXFOCBWPJNTI-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.24
Rot. Bonds5

About N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide

N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide (PubChem CID 109274517) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide
PubChem CID109274517
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide
SMILESCC(C)CCNC(=O)c1cnc(N2CCCCC2)cn1
InChIInChI=1S/C15H24N4O/c1-12(2)6-7-16-15(20)13-10-18-14(11-17-13)19-8-4-3-5-9-19/h10-12H,3-9H2,1-2H3,(H,16,20)
InChIKeyRIVXFOCBWPJNTI-UHFFFAOYSA-N
XLogP2.24
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methylbutyl)-5-morpholin-4-ylpyrazine-2-carboxamide
CID 109276630
N-pentyl-5-piperidin-1-ylpyrazine-2-carboxamide
CID 109274518
5-(azepan-1-yl)-N-(3-methoxypropyl)pyrazine-2-carboxamide
CID 109276095
5-(azepan-1-yl)-N-(3-methylbutyl)pyridine-2-carboxamide
CID 109195506
5-(2-ethylpiperidin-1-yl)-N-(3-methylbutyl)pyrazine-2-carboxamide
CID 109287769
5-(azepan-1-yl)-N-[2-(4-chlorophenyl)ethyl]pyrazine-2-carboxamide
CID 109285779
N-(2-morpholin-4-ylethyl)-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109273701
5-(azepan-1-yl)-N-(pyridin-4-ylmethyl)pyrazine-2-carboxamide
CID 109283539
N-cyclopropyl-5-pyrrolidin-1-ylpyrazine-2-carboxamide
CID 109271555
5-(azepan-1-yl)-N-(4-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109289329
5-(azepan-1-yl)-N-(1-phenylethyl)pyrazine-2-carboxamide
CID 109280802
N-butyl-5-(4-methylpiperazin-1-yl)pyrazine-2-carboxamide
CID 109272354

Frequently Asked Questions

What is the IUPAC name of N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide (CID 109274517) is N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide is CC(C)CCNC(=O)c1cnc(N2CCCCC2)cn1.
What is the InChIKey of N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
The InChIKey is RIVXFOCBWPJNTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-12(2)6-7-16-15(20)13-10-18-14(11-17-13)19-8-4-3-5-9-19/h10-12H,3-9H2,1-2H3,(H,16,20).
What are the key properties of N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide?
N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 2.24, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylbutyl)-5-piperidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 109274517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).