N-[3-(dimethylamino)propyl]piperidine-4-carboxamide

C11H23N3O — CID 2186960

IUPACN-[3-(dimethylamino)propyl]piperidine-4-carboxamide
SMILESCN(C)CCCNC(=O)C1CCNCC1
InChIInChI=1S/C11H23N3O/c1-14(2)9-3-6-13-11(15)10-4-7-12-8-5-10/h10,12H,3-9H2,1-2H3,(H,13,15)
InChIKeyIYOJOIMVFKLABR-UHFFFAOYSA-N
MW213.32 g/mol
LogP0.05
Rot. Bonds5

About N-[3-(dimethylamino)propyl]piperidine-4-carboxamide

N-[3-(dimethylamino)propyl]piperidine-4-carboxamide (PubChem CID 2186960) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]piperidine-4-carboxamide
PubChem CID2186960
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC NameN-[3-(dimethylamino)propyl]piperidine-4-carboxamide
SMILESCN(C)CCCNC(=O)C1CCNCC1
InChIInChI=1S/C11H23N3O/c1-14(2)9-3-6-13-11(15)10-4-7-12-8-5-10/h10,12H,3-9H2,1-2H3,(H,13,15)
InChIKeyIYOJOIMVFKLABR-UHFFFAOYSA-N
XLogP0.05
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]piperidine-4-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]piperidine-4-carboxamide (CID 2186960) is N-[3-(dimethylamino)propyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]piperidine-4-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]piperidine-4-carboxamide is CN(C)CCCNC(=O)C1CCNCC1.
What is the InChIKey of N-[3-(dimethylamino)propyl]piperidine-4-carboxamide?
The InChIKey is IYOJOIMVFKLABR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-14(2)9-3-6-13-11(15)10-4-7-12-8-5-10/h10,12H,3-9H2,1-2H3,(H,13,15).
What are the key properties of N-[3-(dimethylamino)propyl]piperidine-4-carboxamide?
N-[3-(dimethylamino)propyl]piperidine-4-carboxamide has a molecular weight of 213.32 g/mol, XLogP of 0.05, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]piperidine-4-carboxamide is sourced from PubChem (CID 2186960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).