N-piperidin-4-ylformamide

C6H12N2O — CID 18695554

IUPACN-piperidin-4-ylformamide
SMILESO=CNC1CCNCC1
InChIInChI=1S/C6H12N2O/c9-5-8-6-1-3-7-4-2-6/h5-7H,1-4H2,(H,8,9)
InChIKeyQQWXHHWNGQDRCX-UHFFFAOYSA-N
MW128.18 g/mol
LogP-0.52
Rot. Bonds2

About N-piperidin-4-ylformamide

N-piperidin-4-ylformamide (PubChem CID 18695554) has the molecular formula C6H12N2O and a molecular weight of 128.18 g/mol. Its IUPAC name is N-piperidin-4-ylformamide.

Molecular Properties

Compound NameN-piperidin-4-ylformamide
PubChem CID18695554
Molecular FormulaC6H12N2O
Molecular Weight128.18 g/mol
Exact Mass128.09
IUPAC NameN-piperidin-4-ylformamide
SMILESO=CNC1CCNCC1
InChIInChI=1S/C6H12N2O/c9-5-8-6-1-3-7-4-2-6/h5-7H,1-4H2,(H,8,9)
InChIKeyQQWXHHWNGQDRCX-UHFFFAOYSA-N
XLogP-0.52
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.18
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-piperidin-4-ylformamide?
The IUPAC name of N-piperidin-4-ylformamide (CID 18695554) is N-piperidin-4-ylformamide.
What is the SMILES notation for N-piperidin-4-ylformamide?
The canonical SMILES for N-piperidin-4-ylformamide is O=CNC1CCNCC1.
What is the InChIKey of N-piperidin-4-ylformamide?
The InChIKey is QQWXHHWNGQDRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O/c9-5-8-6-1-3-7-4-2-6/h5-7H,1-4H2,(H,8,9).
What are the key properties of N-piperidin-4-ylformamide?
N-piperidin-4-ylformamide has a molecular weight of 128.18 g/mol, XLogP of -0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-4-ylformamide is sourced from PubChem (CID 18695554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).