N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide

C12H23N3O — CID 69044231

IUPACN-methyl-4-piperidin-4-ylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C2CCNCC2)CC1
InChIInChI=1S/C12H23N3O/c1-13-12(16)15-8-4-11(5-9-15)10-2-6-14-7-3-10/h10-11,14H,2-9H2,1H3,(H,13,16)
InChIKeyMMNBHUZICAFDGJ-UHFFFAOYSA-N
MW225.34 g/mol
LogP1.04
Rot. Bonds1

About N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide

N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide (PubChem CID 69044231) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-methyl-4-piperidin-4-ylpiperidine-1-carboxamide
PubChem CID69044231
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-methyl-4-piperidin-4-ylpiperidine-1-carboxamide
SMILESCNC(=O)N1CCC(C2CCNCC2)CC1
InChIInChI=1S/C12H23N3O/c1-13-12(16)15-8-4-11(5-9-15)10-2-6-14-7-3-10/h10-11,14H,2-9H2,1H3,(H,13,16)
InChIKeyMMNBHUZICAFDGJ-UHFFFAOYSA-N
XLogP1.04
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide?
The IUPAC name of N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide (CID 69044231) is N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide?
The canonical SMILES for N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide is CNC(=O)N1CCC(C2CCNCC2)CC1.
What is the InChIKey of N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide?
The InChIKey is MMNBHUZICAFDGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-13-12(16)15-8-4-11(5-9-15)10-2-6-14-7-3-10/h10-11,14H,2-9H2,1H3,(H,13,16).
What are the key properties of N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide?
N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide has a molecular weight of 225.34 g/mol, XLogP of 1.04, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-piperidin-4-ylpiperidine-1-carboxamide is sourced from PubChem (CID 69044231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).