N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide

C17H26N6O — CID 51078473

IUPACN-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H26N6O/c24-17(20-14-3-7-21(8-4-14)15-1-2-15)23-11-9-22(10-12-23)16-13-18-5-6-19-16/h5-6,13-15H,1-4,7-12H2,(H,20,24)
InChIKeyBIRNOBWCEPOQKH-UHFFFAOYSA-N
MW330.44 g/mol
LogP0.94
Rot. Bonds3

About N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide

N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide (PubChem CID 51078473) has the molecular formula C17H26N6O and a molecular weight of 330.44 g/mol. Its IUPAC name is N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide
PubChem CID51078473
Molecular FormulaC17H26N6O
Molecular Weight330.44 g/mol
Exact Mass330.22
IUPAC NameN-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide
SMILESO=C(NC1CCN(C2CC2)CC1)N1CCN(c2cnccn2)CC1
InChIInChI=1S/C17H26N6O/c24-17(20-14-3-7-21(8-4-14)15-1-2-15)23-11-9-22(10-12-23)16-13-18-5-6-19-16/h5-6,13-15H,1-4,7-12H2,(H,20,24)
InChIKeyBIRNOBWCEPOQKH-UHFFFAOYSA-N
XLogP0.94
TPSA64.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.44
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide?
The IUPAC name of N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide (CID 51078473) is N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide?
The canonical SMILES for N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide is O=C(NC1CCN(C2CC2)CC1)N1CCN(c2cnccn2)CC1.
What is the InChIKey of N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide?
The InChIKey is BIRNOBWCEPOQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N6O/c24-17(20-14-3-7-21(8-4-14)15-1-2-15)23-11-9-22(10-12-23)16-13-18-5-6-19-16/h5-6,13-15H,1-4,7-12H2,(H,20,24).
What are the key properties of N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide?
N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide has a molecular weight of 330.44 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpiperidin-4-yl)-4-pyrazin-2-ylpiperazine-1-carboxamide is sourced from PubChem (CID 51078473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).