N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide

C14H25N3O2 — CID 55149500

IUPACN-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide
SMILESCC(C)C(=O)N1CCC(NC(=O)C2CCNC2)CC1
InChIInChI=1S/C14H25N3O2/c1-10(2)14(19)17-7-4-12(5-8-17)16-13(18)11-3-6-15-9-11/h10-12,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyFCVSWJGUIHUZDB-UHFFFAOYSA-N
MW267.37 g/mol
LogP0.36
Rot. Bonds3

About N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide

N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide (PubChem CID 55149500) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide
PubChem CID55149500
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC NameN-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide
SMILESCC(C)C(=O)N1CCC(NC(=O)C2CCNC2)CC1
InChIInChI=1S/C14H25N3O2/c1-10(2)14(19)17-7-4-12(5-8-17)16-13(18)11-3-6-15-9-11/h10-12,15H,3-9H2,1-2H3,(H,16,18)
InChIKeyFCVSWJGUIHUZDB-UHFFFAOYSA-N
XLogP0.36
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide?
The IUPAC name of N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide (CID 55149500) is N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide.
What is the SMILES notation for N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide?
The canonical SMILES for N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide is CC(C)C(=O)N1CCC(NC(=O)C2CCNC2)CC1.
What is the InChIKey of N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide?
The InChIKey is FCVSWJGUIHUZDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-10(2)14(19)17-7-4-12(5-8-17)16-13(18)11-3-6-15-9-11/h10-12,15H,3-9H2,1-2H3,(H,16,18).
What are the key properties of N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide?
N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide has a molecular weight of 267.37 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-methylpropanoyl)piperidin-4-yl]pyrrolidine-3-carboxamide is sourced from PubChem (CID 55149500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).