N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide

C13H24N2O — CID 21409944

IUPACN-[(1-piperidin-1-ylcyclohexyl)methyl]formamide
SMILESO=CNCC1(N2CCCCC2)CCCCC1
InChIInChI=1S/C13H24N2O/c16-12-14-11-13(7-3-1-4-8-13)15-9-5-2-6-10-15/h12H,1-11H2,(H,14,16)
InChIKeyJHKKEDUJTWOLCJ-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.92
Rot. Bonds4

About N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide

N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide (PubChem CID 21409944) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide.

Molecular Properties

Compound NameN-[(1-piperidin-1-ylcyclohexyl)methyl]formamide
PubChem CID21409944
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC NameN-[(1-piperidin-1-ylcyclohexyl)methyl]formamide
SMILESO=CNCC1(N2CCCCC2)CCCCC1
InChIInChI=1S/C13H24N2O/c16-12-14-11-13(7-3-1-4-8-13)15-9-5-2-6-10-15/h12H,1-11H2,(H,14,16)
InChIKeyJHKKEDUJTWOLCJ-UHFFFAOYSA-N
XLogP1.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.92
H-Bond Donors ≤ 51
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-[(1-piperidin-1-ylcyclohexyl)methyl]formamide?
The IUPAC name of N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide (CID 21409944) is N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide.
What is the SMILES notation for N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide?
The canonical SMILES for N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide is O=CNCC1(N2CCCCC2)CCCCC1.
What is the InChIKey of N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide?
The InChIKey is JHKKEDUJTWOLCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c16-12-14-11-13(7-3-1-4-8-13)15-9-5-2-6-10-15/h12H,1-11H2,(H,14,16).
What are the key properties of N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide?
N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide has a molecular weight of 224.35 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-piperidin-1-ylcyclohexyl)methyl]formamide is sourced from PubChem (CID 21409944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).