1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide

C14H25N3O2 — CID 115627671

IUPAC1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide
SMILESC/C=C/CCNC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C14H25N3O2/c1-4-5-6-9-15-13(18)12-7-10-17(11-8-12)14(19)16(2)3/h4-5,12H,6-11H2,1-3H3,(H,15,18)/b5-4+
InChIKeySVDWGQMNNIZRDO-SNAWJCMRSA-N
MW267.37 g/mol
LogP1.46
Rot. Bonds4

About 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide

1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide (PubChem CID 115627671) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide
PubChem CID115627671
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide
SMILESC/C=C/CCNC(=O)C1CCN(C(=O)N(C)C)CC1
InChIInChI=1S/C14H25N3O2/c1-4-5-6-9-15-13(18)12-7-10-17(11-8-12)14(19)16(2)3/h4-5,12H,6-11H2,1-3H3,(H,15,18)/b5-4+
InChIKeySVDWGQMNNIZRDO-SNAWJCMRSA-N
XLogP1.46
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide (CID 115627671) is 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide is C/C=C/CCNC(=O)C1CCN(C(=O)N(C)C)CC1.
What is the InChIKey of 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide?
The InChIKey is SVDWGQMNNIZRDO-SNAWJCMRSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-4-5-6-9-15-13(18)12-7-10-17(11-8-12)14(19)16(2)3/h4-5,12H,6-11H2,1-3H3,(H,15,18)/b5-4+.
What are the key properties of 1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide?
1-N,1-N-dimethyl-4-N-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide has a molecular weight of 267.37 g/mol, XLogP of 1.46, 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-[(E)-pent-3-enyl]piperidine-1,4-dicarboxamide is sourced from PubChem (CID 115627671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).