1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide

C14H27N3O2 — CID 3243850

IUPAC1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide
SMILESCC(C)CCNC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C14H27N3O2/c1-11(2)5-8-15-13(18)12-6-9-17(10-7-12)14(19)16(3)4/h11-12H,5-10H2,1-4H3,(H,15,18)
InChIKeyBTNLKCBFFVKGJR-UHFFFAOYSA-N
MW269.39 g/mol
LogP1.54
Rot. Bonds4

About 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide

1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide (PubChem CID 3243850) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide
PubChem CID3243850
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide
SMILESCC(C)CCNC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C14H27N3O2/c1-11(2)5-8-15-13(18)12-6-9-17(10-7-12)14(19)16(3)4/h11-12H,5-10H2,1-4H3,(H,15,18)
InChIKeyBTNLKCBFFVKGJR-UHFFFAOYSA-N
XLogP1.54
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide (CID 3243850) is 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide is CC(C)CCNC(=O)C1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide?
The InChIKey is BTNLKCBFFVKGJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c1-11(2)5-8-15-13(18)12-6-9-17(10-7-12)14(19)16(3)4/h11-12H,5-10H2,1-4H3,(H,15,18).
What are the key properties of 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide?
1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide has a molecular weight of 269.39 g/mol, XLogP of 1.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-dimethyl-4-N-(3-methylbutyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 3243850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).