N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide

C14H23N5O2 — CID 63252848

IUPACN-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide
SMILESCCn1ccnc(N2CCCC(C(=O)NCCN)C2)c1=O
InChIInChI=1S/C14H23N5O2/c1-2-18-9-7-16-12(14(18)21)19-8-3-4-11(10-19)13(20)17-6-5-15/h7,9,11H,2-6,8,10,15H2,1H3,(H,17,20)
InChIKeyDYCISNZXCJOEGL-UHFFFAOYSA-N
MW293.37 g/mol
LogP-0.45
Rot. Bonds5

About N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide

N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide (PubChem CID 63252848) has the molecular formula C14H23N5O2 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide
PubChem CID63252848
Molecular FormulaC14H23N5O2
Molecular Weight293.37 g/mol
Exact Mass293.19
IUPAC NameN-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide
SMILESCCn1ccnc(N2CCCC(C(=O)NCCN)C2)c1=O
InChIInChI=1S/C14H23N5O2/c1-2-18-9-7-16-12(14(18)21)19-8-3-4-11(10-19)13(20)17-6-5-15/h7,9,11H,2-6,8,10,15H2,1H3,(H,17,20)
InChIKeyDYCISNZXCJOEGL-UHFFFAOYSA-N
XLogP-0.45
TPSA93.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide?
The IUPAC name of N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide (CID 63252848) is N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide.
What is the SMILES notation for N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide?
The canonical SMILES for N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide is CCn1ccnc(N2CCCC(C(=O)NCCN)C2)c1=O.
What is the InChIKey of N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide?
The InChIKey is DYCISNZXCJOEGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c1-2-18-9-7-16-12(14(18)21)19-8-3-4-11(10-19)13(20)17-6-5-15/h7,9,11H,2-6,8,10,15H2,1H3,(H,17,20).
What are the key properties of N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide?
N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of -0.45, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethyl)-1-(4-ethyl-3-oxopyrazin-2-yl)piperidine-3-carboxamide is sourced from PubChem (CID 63252848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).