4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide

C14H25N3O2 — CID 47238287

IUPAC4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide
SMILESCC(C)(C)NC(=O)C1CCN(C(=O)NC2CC2)CC1
InChIInChI=1S/C14H25N3O2/c1-14(2,3)16-12(18)10-6-8-17(9-7-10)13(19)15-11-4-5-11/h10-11H,4-9H2,1-3H3,(H,15,19)(H,16,18)
InChIKeyOVDITYMZCNZRAM-UHFFFAOYSA-N
MW267.37 g/mol
LogP1.49
Rot. Bonds2

About 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide

4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide (PubChem CID 47238287) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide
PubChem CID47238287
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide
SMILESCC(C)(C)NC(=O)C1CCN(C(=O)NC2CC2)CC1
InChIInChI=1S/C14H25N3O2/c1-14(2,3)16-12(18)10-6-8-17(9-7-10)13(19)15-11-4-5-11/h10-11H,4-9H2,1-3H3,(H,15,19)(H,16,18)
InChIKeyOVDITYMZCNZRAM-UHFFFAOYSA-N
XLogP1.49
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide (CID 47238287) is 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide is CC(C)(C)NC(=O)C1CCN(C(=O)NC2CC2)CC1.
What is the InChIKey of 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide?
The InChIKey is OVDITYMZCNZRAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-14(2,3)16-12(18)10-6-8-17(9-7-10)13(19)15-11-4-5-11/h10-11H,4-9H2,1-3H3,(H,15,19)(H,16,18).
What are the key properties of 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide?
4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide has a molecular weight of 267.37 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-tert-butyl-1-N-cyclopropylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 47238287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).