N-pyridin-4-ylpiperazine-1-carboxamide

C10H14N4O — CID 54419684

IUPACN-pyridin-4-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccncc1)N1CCNCC1
InChIInChI=1S/C10H14N4O/c15-10(14-7-5-12-6-8-14)13-9-1-3-11-4-2-9/h1-4,12H,5-8H2,(H,11,13,15)
InChIKeyVZXKHTINTSGPKI-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.52
Rot. Bonds1

About N-pyridin-4-ylpiperazine-1-carboxamide

N-pyridin-4-ylpiperazine-1-carboxamide (PubChem CID 54419684) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is N-pyridin-4-ylpiperazine-1-carboxamide.

Molecular Properties

Compound NameN-pyridin-4-ylpiperazine-1-carboxamide
PubChem CID54419684
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC NameN-pyridin-4-ylpiperazine-1-carboxamide
SMILESO=C(Nc1ccncc1)N1CCNCC1
InChIInChI=1S/C10H14N4O/c15-10(14-7-5-12-6-8-14)13-9-1-3-11-4-2-9/h1-4,12H,5-8H2,(H,11,13,15)
InChIKeyVZXKHTINTSGPKI-UHFFFAOYSA-N
XLogP0.52
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-4-ylpiperazine-1-carboxamide?
The IUPAC name of N-pyridin-4-ylpiperazine-1-carboxamide (CID 54419684) is N-pyridin-4-ylpiperazine-1-carboxamide.
What is the SMILES notation for N-pyridin-4-ylpiperazine-1-carboxamide?
The canonical SMILES for N-pyridin-4-ylpiperazine-1-carboxamide is O=C(Nc1ccncc1)N1CCNCC1.
What is the InChIKey of N-pyridin-4-ylpiperazine-1-carboxamide?
The InChIKey is VZXKHTINTSGPKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c15-10(14-7-5-12-6-8-14)13-9-1-3-11-4-2-9/h1-4,12H,5-8H2,(H,11,13,15).
What are the key properties of N-pyridin-4-ylpiperazine-1-carboxamide?
N-pyridin-4-ylpiperazine-1-carboxamide has a molecular weight of 206.25 g/mol, XLogP of 0.52, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-4-ylpiperazine-1-carboxamide is sourced from PubChem (CID 54419684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).