1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide

C16H27N3O2 — CID 3222855

IUPAC1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide
SMILESO=C(NC1CC1)C1CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C16H27N3O2/c20-15(17-14-8-9-14)12-5-4-10-19(11-12)16(21)18-13-6-2-1-3-7-13/h12-14H,1-11H2,(H,17,20)(H,18,21)
InChIKeyWBAXULBXLGBYRE-UHFFFAOYSA-N
MW293.41 g/mol
LogP2.02
Rot. Bonds3

About 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide

1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide (PubChem CID 3222855) has the molecular formula C16H27N3O2 and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide.

Molecular Properties

Compound Name1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide
PubChem CID3222855
Molecular FormulaC16H27N3O2
Molecular Weight293.41 g/mol
Exact Mass293.21
IUPAC Name1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide
SMILESO=C(NC1CC1)C1CCCN(C(=O)NC2CCCCC2)C1
InChIInChI=1S/C16H27N3O2/c20-15(17-14-8-9-14)12-5-4-10-19(11-12)16(21)18-13-6-2-1-3-7-13/h12-14H,1-11H2,(H,17,20)(H,18,21)
InChIKeyWBAXULBXLGBYRE-UHFFFAOYSA-N
XLogP2.02
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide?
The IUPAC name of 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide (CID 3222855) is 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide.
What is the SMILES notation for 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide?
The canonical SMILES for 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide is O=C(NC1CC1)C1CCCN(C(=O)NC2CCCCC2)C1.
What is the InChIKey of 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide?
The InChIKey is WBAXULBXLGBYRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O2/c20-15(17-14-8-9-14)12-5-4-10-19(11-12)16(21)18-13-6-2-1-3-7-13/h12-14H,1-11H2,(H,17,20)(H,18,21).
What are the key properties of 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide?
1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide has a molecular weight of 293.41 g/mol, XLogP of 2.02, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-cyclohexyl-3-N-cyclopropylpiperidine-1,3-dicarboxamide is sourced from PubChem (CID 3222855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).