4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide

C13H25N3O — CID 79159545

IUPAC4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCC2CCNCC2)CC1
InChIInChI=1S/C13H25N3O/c1-11-4-8-16(9-5-11)13(17)15-10-12-2-6-14-7-3-12/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyCVMBOOLZFBGTRV-UHFFFAOYSA-N
MW239.36 g/mol
LogP1.43
Rot. Bonds2

About 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide

4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide (PubChem CID 79159545) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide
PubChem CID79159545
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide
SMILESCC1CCN(C(=O)NCC2CCNCC2)CC1
InChIInChI=1S/C13H25N3O/c1-11-4-8-16(9-5-11)13(17)15-10-12-2-6-14-7-3-12/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyCVMBOOLZFBGTRV-UHFFFAOYSA-N
XLogP1.43
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide?
The IUPAC name of 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide (CID 79159545) is 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide?
The canonical SMILES for 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide is CC1CCN(C(=O)NCC2CCNCC2)CC1.
What is the InChIKey of 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide?
The InChIKey is CVMBOOLZFBGTRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-11-4-8-16(9-5-11)13(17)15-10-12-2-6-14-7-3-12/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide?
4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide has a molecular weight of 239.36 g/mol, XLogP of 1.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(piperidin-4-ylmethyl)piperidine-1-carboxamide is sourced from PubChem (CID 79159545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).