(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide

C10H13BrN4O — CID 81134417

IUPAC(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide
SMILESO=C(Nc1cnc(Br)cn1)[C@@H]1CCCNC1
InChIInChI=1S/C10H13BrN4O/c11-8-5-14-9(6-13-8)15-10(16)7-2-1-3-12-4-7/h5-7,12H,1-4H2,(H,14,15,16)/t7-/m1/s1
InChIKeyIXAVFUHIMSSQTM-SSDOTTSWSA-N
MW285.14 g/mol
LogP1.18
Rot. Bonds2

About (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide

(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide (PubChem CID 81134417) has the molecular formula C10H13BrN4O and a molecular weight of 285.14 g/mol. Its IUPAC name is (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide
PubChem CID81134417
Molecular FormulaC10H13BrN4O
Molecular Weight285.14 g/mol
Exact Mass284.03
IUPAC Name(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide
SMILESO=C(Nc1cnc(Br)cn1)[C@@H]1CCCNC1
InChIInChI=1S/C10H13BrN4O/c11-8-5-14-9(6-13-8)15-10(16)7-2-1-3-12-4-7/h5-7,12H,1-4H2,(H,14,15,16)/t7-/m1/s1
InChIKeyIXAVFUHIMSSQTM-SSDOTTSWSA-N
XLogP1.18
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.14
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-pyrazin-2-ylpiperidine-3-carboxamide
CID 43616168
N-(5-bromopyrazin-2-yl)-4-methylcyclohexane-1-carboxamide
CID 80502105
N-(5-bromo-6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 79048485
4-(aminomethyl)-N-(5-bromopyrazin-2-yl)cyclohexane-1-carboxamide
CID 79526691
(3S)-N-(1,2-oxazol-3-yl)piperidine-3-carboxamide
CID 81139342
N-(5-bromo-2-pyridinyl)-1-(piperidine-3-carbonyl)piperidine-3-carboxamide
CID 119856395
(3R)-N-(1H-imidazol-2-yl)piperidine-3-carboxamide
CID 81139688
(3S)-N-(2,4,6-tribromophenyl)piperidine-3-carboxamide
CID 28992192
N-(5-cycloheptyl-1H-pyrazol-3-yl)piperidine-3-carboxamide
CID 119329603
(3R)-N-(4,6-dichloropyrimidin-5-yl)piperidine-3-carboxamide
CID 114074295
N-(6-chloro-3-pyridinyl)piperidine-3-carboxamide
CID 81426071
N-(6-methyl-2-pyridinyl)piperidine-3-carboxamide
CID 43185838

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide?
The IUPAC name of (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide (CID 81134417) is (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide is O=C(Nc1cnc(Br)cn1)[C@@H]1CCCNC1.
What is the InChIKey of (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide?
The InChIKey is IXAVFUHIMSSQTM-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H13BrN4O/c11-8-5-14-9(6-13-8)15-10(16)7-2-1-3-12-4-7/h5-7,12H,1-4H2,(H,14,15,16)/t7-/m1/s1.
What are the key properties of (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide?
(3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide has a molecular weight of 285.14 g/mol, XLogP of 1.18, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(5-bromopyrazin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 81134417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).