(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid

C5H10FNO3 — CID 126688385

IUPAC(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid
SMILESCC(F)(CO)CNC(=O)O
InChIInChI=1S/C5H10FNO3/c1-5(6,3-8)2-7-4(9)10/h7-8H,2-3H2,1H3,(H,9,10)
InChIKeyDGBDSZWHLGIMLX-UHFFFAOYSA-N
MW151.14 g/mol
LogP-0.03
Rot. Bonds3

About (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid

(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid (PubChem CID 126688385) has the molecular formula C5H10FNO3 and a molecular weight of 151.14 g/mol. Its IUPAC name is (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid.

Molecular Properties

Compound Name(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid
PubChem CID126688385
Molecular FormulaC5H10FNO3
Molecular Weight151.14 g/mol
Exact Mass151.06
IUPAC Name(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid
SMILESCC(F)(CO)CNC(=O)O
InChIInChI=1S/C5H10FNO3/c1-5(6,3-8)2-7-4(9)10/h7-8H,2-3H2,1H3,(H,9,10)
InChIKeyDGBDSZWHLGIMLX-UHFFFAOYSA-N
XLogP-0.03
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.14
LogP ≤ 5-0.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

4-(carboxyamino)-3,3-dimethylbutanoic acid
CID 122599753
(3-amino-2,2-difluoropropyl)carbamic acid
CID 121434560
2,2-difluoro-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propanoic acid
CID 165464166
(6-hydroxy-5,5-dimethylhexyl)carbamic acid
CID 90923983
N-(2-fluoro-2-methylbutyl)cyclopropanecarboxamide
CID 123444332
(2S)-3,3,3-trifluoro-2-(hydroxymethyl)-2-methylpropanoic acid
CID 162549320
(5,5,5-trifluoro-4-hydroxy-4-methylpent-2-ynyl)carbamic acid
CID 151886577
[2-(4-fluoro-3-methylphenyl)-2-methylpropyl]carbamic acid
CID 115171370
[2-(carboxyamino)-4-hydroxy-2-(2-hydroxyethyl)butyl]carbamic acid
CID 57076198
[2-methyl-2-(2,4,6-trimethylphenyl)propyl]carbamic acid
CID 115171394
2,2-difluoro-3-[(1-hydroxy-2-methylbutan-2-yl)amino]propanoic acid
CID 165465852
[2-[(carboxyamino)methyl]-3,3-dimethylbutyl]carbamic acid
CID 90470587

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid?
The IUPAC name of (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid (CID 126688385) is (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid.
What is the SMILES notation for (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid?
The canonical SMILES for (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid is CC(F)(CO)CNC(=O)O.
What is the InChIKey of (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid?
The InChIKey is DGBDSZWHLGIMLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10FNO3/c1-5(6,3-8)2-7-4(9)10/h7-8H,2-3H2,1H3,(H,9,10).
What are the key properties of (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid?
(2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid has a molecular weight of 151.14 g/mol, XLogP of -0.03, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-3-hydroxy-2-methylpropyl)carbamic acid is sourced from PubChem (CID 126688385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).