N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide

C10H20N2O4 — CID 103749296

IUPACN-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide
SMILESCCC(CO)(CO)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O4/c1-2-10(7-13,8-14)11-9(15)12-3-5-16-6-4-12/h13-14H,2-8H2,1H3,(H,11,15)
InChIKeyUZMSJZZAPFISEB-UHFFFAOYSA-N
MW232.28 g/mol
LogP-0.84
Rot. Bonds4

About N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide

N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide (PubChem CID 103749296) has the molecular formula C10H20N2O4 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide
PubChem CID103749296
Molecular FormulaC10H20N2O4
Molecular Weight232.28 g/mol
Exact Mass232.14
IUPAC NameN-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide
SMILESCCC(CO)(CO)NC(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O4/c1-2-10(7-13,8-14)11-9(15)12-3-5-16-6-4-12/h13-14H,2-8H2,1H3,(H,11,15)
InChIKeyUZMSJZZAPFISEB-UHFFFAOYSA-N
XLogP-0.84
TPSA82.03 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 5-0.84
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(hydroxymethyl)pentan-3-yl]-4-methylpiperidine-1-carboxamide
CID 79159386
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)morpholine-4-carboxamide
CID 79152780
butane;N-methylmorpholine-4-carboxamide;propane
CID 143336598
N-propylmorpholine-4-carboxamide
CID 3410822
4-methyl-4-(morpholine-4-carbonylamino)pentanoic acid
CID 62050012
N-propan-2-ylmorpholine-4-carboxamide
CID 3411412
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]oxolane-2-carboxamide
CID 103890903
3,3,3-trifluoro-2-methyl-2-(1,4-oxazepane-4-carbonylamino)propanoic acid
CID 79801375
N-acetylmorpholine-4-carboxamide
CID 102407930
N-(4-hydroxy-2,2-dimethylbutyl)morpholine-4-carboxamide
CID 103713760
1-acetyl-N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]piperidine-4-carboxamide
CID 104629931
N-(2-methylbutan-2-yl)azepane-1-carboxamide
CID 116653730

Frequently Asked Questions

What is the IUPAC name of N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide?
The IUPAC name of N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide (CID 103749296) is N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide?
The canonical SMILES for N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide is CCC(CO)(CO)NC(=O)N1CCOCC1.
What is the InChIKey of N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide?
The InChIKey is UZMSJZZAPFISEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4/c1-2-10(7-13,8-14)11-9(15)12-3-5-16-6-4-12/h13-14H,2-8H2,1H3,(H,11,15).
What are the key properties of N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide?
N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide has a molecular weight of 232.28 g/mol, XLogP of -0.84, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-hydroxy-2-(hydroxymethyl)butan-2-yl]morpholine-4-carboxamide is sourced from PubChem (CID 103749296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).