N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide

C13H26N2O3 — CID 63876579

IUPACN-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide
SMILESCC(C)CC(CO)NC(=O)COC1CCNCC1
InChIInChI=1S/C13H26N2O3/c1-10(2)7-11(8-16)15-13(17)9-18-12-3-5-14-6-4-12/h10-12,14,16H,3-9H2,1-2H3,(H,15,17)
InChIKeyIQAZSQQDCFMUAO-UHFFFAOYSA-N
MW258.36 g/mol
LogP0.28
Rot. Bonds7

About N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide

N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide (PubChem CID 63876579) has the molecular formula C13H26N2O3 and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide.

Molecular Properties

Compound NameN-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide
PubChem CID63876579
Molecular FormulaC13H26N2O3
Molecular Weight258.36 g/mol
Exact Mass258.19
IUPAC NameN-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide
SMILESCC(C)CC(CO)NC(=O)COC1CCNCC1
InChIInChI=1S/C13H26N2O3/c1-10(2)7-11(8-16)15-13(17)9-18-12-3-5-14-6-4-12/h10-12,14,16H,3-9H2,1-2H3,(H,15,17)
InChIKeyIQAZSQQDCFMUAO-UHFFFAOYSA-N
XLogP0.28
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 50.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

(5S)-5-(2-methylpropyl)morpholin-3-one
CID 15225763
N-[(3S,4S)-4-(hydroxymethyl)-1-tetrahydro-2H-pyran-4-ylhexahydro-3-pyridinyl]-2-methoxyacetamide
CID 91920876
(2R,5R)-5-(2-methylpropyl)-2-propan-2-ylmorpholin-3-one
CID 134837663
2-butoxy-N-[(4-hydroxy-1-methylpiperidin-4-yl)methyl]propanamide
CID 72113425
5-(2-Methylpropyl)morpholin-3-one
CID 20063804
2-piperidin-4-yloxy-N-propan-2-ylacetamide
CID 43346287
(5R)-5-(2-methylpropyl)morpholin-3-one
CID 53756559
(6S)-6-(2-methylpropyl)morpholin-3-one
CID 57733875
N-[(4S)-5-acetamido-4-hydroxypentan-2-yl]-2-ethoxyacetamide
CID 88276145
1-[(5R)-2-[(1S)-1-hydroxyethyl]-5-[2-(propylamino)ethyl]piperidin-1-yl]-2-methoxyethanone
CID 126669713
4-[(2S)-1-hydroxy-4-methylpentan-2-yl]-6-methylmorpholine-2-carboxamide
CID 140671740
4-[(2R)-1-hydroxy-4-methylpentan-2-yl]-6-methylmorpholine-2-carboxamide
CID 140671806

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide?
The IUPAC name of N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide (CID 63876579) is N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide.
What is the SMILES notation for N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide?
The canonical SMILES for N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide is CC(C)CC(CO)NC(=O)COC1CCNCC1.
What is the InChIKey of N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide?
The InChIKey is IQAZSQQDCFMUAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3/c1-10(2)7-11(8-16)15-13(17)9-18-12-3-5-14-6-4-12/h10-12,14,16H,3-9H2,1-2H3,(H,15,17).
What are the key properties of N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide?
N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide has a molecular weight of 258.36 g/mol, XLogP of 0.28, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-4-methylpentan-2-yl)-2-piperidin-4-yloxyacetamide is sourced from PubChem (CID 63876579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).