N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide

C10H20N2O3 — CID 111444624

IUPACN-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
SMILESCC(CO)C(C)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O3/c1-8(7-13)9(2)11-10(14)12-3-5-15-6-4-12/h8-9,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyBWDVBAJDANVCLS-UHFFFAOYSA-N
MW216.28 g/mol
LogP0.05
Rot. Bonds3

About N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide

N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide (PubChem CID 111444624) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
PubChem CID111444624
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC NameN-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide
SMILESCC(CO)C(C)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O3/c1-8(7-13)9(2)11-10(14)12-3-5-15-6-4-12/h8-9,13H,3-7H2,1-2H3,(H,11,14)
InChIKeyBWDVBAJDANVCLS-UHFFFAOYSA-N
XLogP0.05
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-ylmorpholine-4-carboxamide
CID 3411412
2-[(4-hydroxy-3-methylbutan-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 113484800
N-(1-amino-3-methylbutan-2-yl)morpholine-4-carboxamide
CID 79155057
N-(4-methylsulfanylbutan-2-yl)morpholine-4-carboxamide
CID 115640219
N-(4-amino-4-oxobutan-2-yl)morpholine-4-carboxamide
CID 115665185
N-[(2S)-1,4-dihydroxy-4-methylpentan-2-yl]morpholine-4-carboxamide
CID 58378093
N-(1,4-dihydroxy-4-methylpentan-2-yl)morpholine-4-carboxamide
CID 67359401
N-(2,3-dimethylbutyl)morpholine-4-carboxamide
CID 115642976
N-(1-cyclopropylpropan-2-yl)morpholine-4-carboxamide
CID 115624308
N-[1-(oxan-4-yl)ethyl]morpholine-4-carboxamide
CID 103768181
N-(1-morpholin-4-yl-1-oxopropan-2-yl)pyrrolidine-1-carboxamide
CID 116657750
3-methyl-2-(morpholine-4-carbonylamino)butanoyl iodide
CID 129144228

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide (CID 111444624) is N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide is CC(CO)C(C)NC(=O)N1CCOCC1.
What is the InChIKey of N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide?
The InChIKey is BWDVBAJDANVCLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-8(7-13)9(2)11-10(14)12-3-5-15-6-4-12/h8-9,13H,3-7H2,1-2H3,(H,11,14).
What are the key properties of N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide?
N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide has a molecular weight of 216.28 g/mol, XLogP of 0.05, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-3-methylbutan-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 111444624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).