(3S)-N,N-diethylpiperidine-3-carboxamide

C10H20N2O — CID 643513

IUPAC(3S)-N,N-diethylpiperidine-3-carboxamide
SMILESCCN(CC)C(=O)[C@H]1CCCNC1
InChIInChI=1S/C10H20N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h9,11H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyZXQKYQVJDRTTLZ-VIFPVBQESA-N
MW184.28 g/mol
LogP0.85
Rot. Bonds3

About (3S)-N,N-diethylpiperidine-3-carboxamide

(3S)-N,N-diethylpiperidine-3-carboxamide (PubChem CID 643513) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (3S)-N,N-diethylpiperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-N,N-diethylpiperidine-3-carboxamide
PubChem CID643513
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(3S)-N,N-diethylpiperidine-3-carboxamide
SMILESCCN(CC)C(=O)[C@H]1CCCNC1
InChIInChI=1S/C10H20N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h9,11H,3-8H2,1-2H3/t9-/m0/s1
InChIKeyZXQKYQVJDRTTLZ-VIFPVBQESA-N
XLogP0.85
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-N,N-diethylpiperidine-3-carboxamide?
The IUPAC name of (3S)-N,N-diethylpiperidine-3-carboxamide (CID 643513) is (3S)-N,N-diethylpiperidine-3-carboxamide.
What is the SMILES notation for (3S)-N,N-diethylpiperidine-3-carboxamide?
The canonical SMILES for (3S)-N,N-diethylpiperidine-3-carboxamide is CCN(CC)C(=O)[C@H]1CCCNC1.
What is the InChIKey of (3S)-N,N-diethylpiperidine-3-carboxamide?
The InChIKey is ZXQKYQVJDRTTLZ-VIFPVBQESA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-12(4-2)10(13)9-6-5-7-11-8-9/h9,11H,3-8H2,1-2H3/t9-/m0/s1.
What are the key properties of (3S)-N,N-diethylpiperidine-3-carboxamide?
(3S)-N,N-diethylpiperidine-3-carboxamide has a molecular weight of 184.28 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N,N-diethylpiperidine-3-carboxamide is sourced from PubChem (CID 643513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).