N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide

C14H26N2O3 — CID 112542715

IUPACN-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide
SMILESCCC(=O)N1CC(NC(=O)C(C)C)CC(C(C)O)C1
InChIInChI=1S/C14H26N2O3/c1-5-13(18)16-7-11(10(4)17)6-12(8-16)15-14(19)9(2)3/h9-12,17H,5-8H2,1-4H3,(H,15,19)
InChIKeyBLOBDSKVJBEGHC-UHFFFAOYSA-N
MW270.37 g/mol
LogP0.77
Rot. Bonds4

About N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide

N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide (PubChem CID 112542715) has the molecular formula C14H26N2O3 and a molecular weight of 270.37 g/mol. Its IUPAC name is N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide.

Molecular Properties

Compound NameN-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide
PubChem CID112542715
Molecular FormulaC14H26N2O3
Molecular Weight270.37 g/mol
Exact Mass270.19
IUPAC NameN-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide
SMILESCCC(=O)N1CC(NC(=O)C(C)C)CC(C(C)O)C1
InChIInChI=1S/C14H26N2O3/c1-5-13(18)16-7-11(10(4)17)6-12(8-16)15-14(19)9(2)3/h9-12,17H,5-8H2,1-4H3,(H,15,19)
InChIKeyBLOBDSKVJBEGHC-UHFFFAOYSA-N
XLogP0.77
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-propanoyl-5-propan-2-ylpiperidin-3-yl)acetamide
CID 112541818
1-[3-(benzylamino)-5-(1-hydroxyethyl)piperidin-1-yl]propan-1-one
CID 83993705
methyl 3-(1-hydroxypropyl)-5-(2-methylpropanoylamino)piperidine-1-carboxylate
CID 112542661
methyl N-[5-(1-hydroxyethyl)-1-(3-methylbutanoyl)piperidin-3-yl]carbamate
CID 112543245
ethyl 3-(ethoxycarbonylamino)-5-(1-hydroxyethyl)piperidine-1-carboxylate
CID 112543799
2-methyl-N-(1-propanoylpiperidin-4-yl)propanamide
CID 60769090
1-[3-(1-hydroxyethyl)-5-(methylamino)piperidin-1-yl]ethanone
CID 83989743
N-[1-acetyl-5-(1-hydroxyethyl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 112542253
N-[1-(1-cyclobutylethyl)-5-(1-hydroxyethyl)piperidin-3-yl]-2-methylpropanamide
CID 112542898
1-[3-(1-hydroxyethyl)-5-(methylamino)piperidin-1-yl]-2-methylpropan-1-one
CID 83989811
1-[3-(2,2-dimethylpropylamino)-5-(1-hydroxyethyl)piperidin-1-yl]ethanone
CID 83995067
N-[5-(1-hydroxyethyl)-1-(2-methylpropanoyl)piperidin-3-yl]-2,2-dimethylpropanamide
CID 112542313

Frequently Asked Questions

What is the IUPAC name of N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide?
The IUPAC name of N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide (CID 112542715) is N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide.
What is the SMILES notation for N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide?
The canonical SMILES for N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide is CCC(=O)N1CC(NC(=O)C(C)C)CC(C(C)O)C1.
What is the InChIKey of N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide?
The InChIKey is BLOBDSKVJBEGHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3/c1-5-13(18)16-7-11(10(4)17)6-12(8-16)15-14(19)9(2)3/h9-12,17H,5-8H2,1-4H3,(H,15,19).
What are the key properties of N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide?
N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide has a molecular weight of 270.37 g/mol, XLogP of 0.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-hydroxyethyl)-1-propanoylpiperidin-3-yl]-2-methylpropanamide is sourced from PubChem (CID 112542715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).