N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide

C15H30N2O2 — CID 164641472

IUPACN-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide
SMILESCC(C)[C@H](CCO)NC(=O)C(C)(C)N1CCCCC1
InChIInChI=1S/C15H30N2O2/c1-12(2)13(8-11-18)16-14(19)15(3,4)17-9-6-5-7-10-17/h12-13,18H,5-11H2,1-4H3,(H,16,19)/t13-/m0/s1
InChIKeyALDIARZLFBPACJ-ZDUSSCGKSA-N
MW270.42 g/mol
LogP1.77
Rot. Bonds6

About N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide

N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide (PubChem CID 164641472) has the molecular formula C15H30N2O2 and a molecular weight of 270.42 g/mol. Its IUPAC name is N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide.

Molecular Properties

Compound NameN-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide
PubChem CID164641472
Molecular FormulaC15H30N2O2
Molecular Weight270.42 g/mol
Exact Mass270.23
IUPAC NameN-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide
SMILESCC(C)[C@H](CCO)NC(=O)C(C)(C)N1CCCCC1
InChIInChI=1S/C15H30N2O2/c1-12(2)13(8-11-18)16-14(19)15(3,4)17-9-6-5-7-10-17/h12-13,18H,5-11H2,1-4H3,(H,16,19)/t13-/m0/s1
InChIKeyALDIARZLFBPACJ-ZDUSSCGKSA-N
XLogP1.77
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.42
LogP ≤ 51.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide?
The IUPAC name of N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide (CID 164641472) is N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide.
What is the SMILES notation for N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide?
The canonical SMILES for N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide is CC(C)[C@H](CCO)NC(=O)C(C)(C)N1CCCCC1.
What is the InChIKey of N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide?
The InChIKey is ALDIARZLFBPACJ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H30N2O2/c1-12(2)13(8-11-18)16-14(19)15(3,4)17-9-6-5-7-10-17/h12-13,18H,5-11H2,1-4H3,(H,16,19)/t13-/m0/s1.
What are the key properties of N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide?
N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide has a molecular weight of 270.42 g/mol, XLogP of 1.77, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3S)-1-hydroxy-4-methylpentan-3-yl]-2-methyl-2-piperidin-1-ylpropanamide is sourced from PubChem (CID 164641472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).