(3S)-3-methyl-N-piperidin-1-ylpentanamide

C11H22N2O — CID 28989899

IUPAC(3S)-3-methyl-N-piperidin-1-ylpentanamide
SMILESCC[C@H](C)CC(=O)NN1CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-10(2)9-11(14)12-13-7-5-4-6-8-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1
InChIKeyHLNXRNVOVGIKDN-JTQLQIEISA-N
MW198.31 g/mol
LogP1.94
Rot. Bonds4

About (3S)-3-methyl-N-piperidin-1-ylpentanamide

(3S)-3-methyl-N-piperidin-1-ylpentanamide (PubChem CID 28989899) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (3S)-3-methyl-N-piperidin-1-ylpentanamide.

Molecular Properties

Compound Name(3S)-3-methyl-N-piperidin-1-ylpentanamide
PubChem CID28989899
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(3S)-3-methyl-N-piperidin-1-ylpentanamide
SMILESCC[C@H](C)CC(=O)NN1CCCCC1
InChIInChI=1S/C11H22N2O/c1-3-10(2)9-11(14)12-13-7-5-4-6-8-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1
InChIKeyHLNXRNVOVGIKDN-JTQLQIEISA-N
XLogP1.94
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-methyl-N-piperidin-1-ylpentanamide?
The IUPAC name of (3S)-3-methyl-N-piperidin-1-ylpentanamide (CID 28989899) is (3S)-3-methyl-N-piperidin-1-ylpentanamide.
What is the SMILES notation for (3S)-3-methyl-N-piperidin-1-ylpentanamide?
The canonical SMILES for (3S)-3-methyl-N-piperidin-1-ylpentanamide is CC[C@H](C)CC(=O)NN1CCCCC1.
What is the InChIKey of (3S)-3-methyl-N-piperidin-1-ylpentanamide?
The InChIKey is HLNXRNVOVGIKDN-JTQLQIEISA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-10(2)9-11(14)12-13-7-5-4-6-8-13/h10H,3-9H2,1-2H3,(H,12,14)/t10-/m0/s1.
What are the key properties of (3S)-3-methyl-N-piperidin-1-ylpentanamide?
(3S)-3-methyl-N-piperidin-1-ylpentanamide has a molecular weight of 198.31 g/mol, XLogP of 1.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-methyl-N-piperidin-1-ylpentanamide is sourced from PubChem (CID 28989899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).