5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide

C17H26N2O4 — CID 56706311

IUPAC5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide
SMILESCC(C)CN1CCCC(CCNC(=O)c2cc(=O)c(O)co2)C1
InChIInChI=1S/C17H26N2O4/c1-12(2)9-19-7-3-4-13(10-19)5-6-18-17(22)16-8-14(20)15(21)11-23-16/h8,11-13,21H,3-7,9-10H2,1-2H3,(H,18,22)
InChIKeyUDLPFHXWJDMHMA-UHFFFAOYSA-N
MW322.41 g/mol
LogP1.83
Rot. Bonds6

About 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide

5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide (PubChem CID 56706311) has the molecular formula C17H26N2O4 and a molecular weight of 322.41 g/mol. Its IUPAC name is 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide.

Molecular Properties

Compound Name5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide
PubChem CID56706311
Molecular FormulaC17H26N2O4
Molecular Weight322.41 g/mol
Exact Mass322.19
IUPAC Name5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide
SMILESCC(C)CN1CCCC(CCNC(=O)c2cc(=O)c(O)co2)C1
InChIInChI=1S/C17H26N2O4/c1-12(2)9-19-7-3-4-13(10-19)5-6-18-17(22)16-8-14(20)15(21)11-23-16/h8,11-13,21H,3-7,9-10H2,1-2H3,(H,18,22)
InChIKeyUDLPFHXWJDMHMA-UHFFFAOYSA-N
XLogP1.83
TPSA82.78 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-[2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]ethyl]pyridine-4-carboxamide
CID 95388316
N-methyl-2-[1-(2-methylpropyl)piperidin-3-yl]ethanamine
CID 83982939
4-[1-(2-methylpropyl)piperidin-3-yl]butan-2-one
CID 83982945
3-hydroxy-N-[[(3S)-1-(2-methylpropyl)piperidin-3-yl]methyl]pyridine-2-carboxamide
CID 95226078
N-[[(3S)-1-(2-methylpropyl)piperidin-3-yl]methyl]acetamide
CID 95187387
2-[[1-[(5-hydroxy-4-oxopyran-2-yl)methyl]piperidin-3-yl]methylamino]acetic acid
CID 106813854
N-(2-cyclopentylethyl)-4-(2-methylpropyl)piperazine-1-carboxamide
CID 78892600
2-[(3R)-1-(2-methylpropyl)piperidin-3-yl]acetic acid
CID 86324356
2-methyl-N-[2-[(3R)-1-methylpiperidin-3-yl]ethyl]-5-propan-2-ylfuran-3-carboxamide
CID 95229686
N-[2-[(3R)-1-(furan-2-ylmethyl)piperidin-3-yl]ethyl]-3-hydroxybenzamide
CID 95226562
2,6-dihydroxy-N-[[(3S)-1-(2-methylpropyl)pyrrolidin-3-yl]methyl]benzamide
CID 95199115
1-amino-N-[[1-(2-methylpropyl)piperidin-3-yl]methyl]cyclopentane-1-carboxamide;dihydrochloride
CID 154886846

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide?
The IUPAC name of 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide (CID 56706311) is 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide.
What is the SMILES notation for 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide?
The canonical SMILES for 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide is CC(C)CN1CCCC(CCNC(=O)c2cc(=O)c(O)co2)C1.
What is the InChIKey of 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide?
The InChIKey is UDLPFHXWJDMHMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4/c1-12(2)9-19-7-3-4-13(10-19)5-6-18-17(22)16-8-14(20)15(21)11-23-16/h8,11-13,21H,3-7,9-10H2,1-2H3,(H,18,22).
What are the key properties of 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide?
5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide has a molecular weight of 322.41 g/mol, XLogP of 1.83, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-N-[2-[1-(2-methylpropyl)piperidin-3-yl]ethyl]-4-oxopyran-2-carboxamide is sourced from PubChem (CID 56706311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).