N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide

C12H17N5O — CID 33384005

IUPACN-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide
SMILESO=C(NC1CC1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C12H17N5O/c18-12(15-10-1-2-10)17-7-5-16(6-8-17)11-9-13-3-4-14-11/h3-4,9-10H,1-2,5-8H2,(H,15,18)
InChIKeyZJNDKJRZGWXTOI-UHFFFAOYSA-N
MW247.30 g/mol
LogP0.47
Rot. Bonds2

About N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide

N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide (PubChem CID 33384005) has the molecular formula C12H17N5O and a molecular weight of 247.30 g/mol. Its IUPAC name is N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide
PubChem CID33384005
Molecular FormulaC12H17N5O
Molecular Weight247.30 g/mol
Exact Mass247.14
IUPAC NameN-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide
SMILESO=C(NC1CC1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C12H17N5O/c18-12(15-10-1-2-10)17-7-5-16(6-8-17)11-9-13-3-4-14-11/h3-4,9-10H,1-2,5-8H2,(H,15,18)
InChIKeyZJNDKJRZGWXTOI-UHFFFAOYSA-N
XLogP0.47
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide (CID 33384005) is N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide is O=C(NC1CC1)N1CCN(c2cnccn2)CC1.
What is the InChIKey of N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide?
The InChIKey is ZJNDKJRZGWXTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5O/c18-12(15-10-1-2-10)17-7-5-16(6-8-17)11-9-13-3-4-14-11/h3-4,9-10H,1-2,5-8H2,(H,15,18).
What are the key properties of N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide?
N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide has a molecular weight of 247.30 g/mol, XLogP of 0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 33384005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).